IPTACOPAN HYDROCHLORIDE ANHYDROUS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H30N2O4.ClH
Molecular Weight	458.978
Optical Activity	( + )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of IPTACOPAN HYDROCHLORIDE ANHYDROUS

Structure Search

SMILES

Cl.CCO[C@H]1CCN(CC2=C(OC)C=C(C)C3=C2C=CN3)[C@@H](C1)C4=CC=C(C=C4)C(O)=O

InChI

InChIKey=SEZXOFFLNHXEJE-CQERKEQDSA-N

InChI=1S/C25H30N2O4.ClH/c1-4-31-19-10-12-27(22(14-19)17-5-7-18(8-6-17)25(28)29)15-21-20-9-11-26-24(20)16(2)13-23(21)30-3;/h5-9,11,13,19,22,26H,4,10,12,14-15H2,1-3H3,(H,28,29);1H/t19-,22-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C25H30N2O4
Molecular Weight	422.5167
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:02:45 GMT 2023` Edited by `admin` on `Sat Dec 16 14:02:45 GMT 2023`
Record UNII	O9HY4W0ZW7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IPTACOPAN HYDROCHLORIDE ANHYDROUS

Common Name

English

4-(2S,4S)-4-ETHOXY-1-((5-METHOXY-7-METHYL-1H-INDOL-4-YL)METHYL)PIPERIDIN-2-YL)BENZOIC ACID-HYDROGEN CHLORIDE(1:1)

Systematic Name

English

LNP023-AAA

Code

English

4-((2S,4S)-4-ETHOXY-1-((5-METHOXY-7-METHYL-1H-INDOL-4-YL)METHYL))PIPERIDIN-2-YL))BENZOIC ACID, HYDROCHLORIDE, HYDRATE (1:1)

Systematic Name

English

BENZOIC ACID, 4-((2S,4S)-4-ETHOXY-1-((5-METHOXY-7-METHYL-1H-INDOL-4-YL)METHYL)-2-PIPERIDINYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Classification Tree Code System Code

EU-Orphan Drug

EU/3/18/2104