3H-Naphtho[1,2,3-de]quinoline-1-carboxylic acid, 2,7-dihydro-4-methyl-6-[(4-methylphenyl)amino]-2,7-dioxo-, ethyl ester

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H22N2O4
Molecular Weight	438.4746
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3H-Naphtho[1,2,3-de]quinoline-1-carboxylic acid, 2,7-dihydro-4-methyl-6-[(4-methylphenyl)amino]-2,7-dioxo-, ethyl ester

Structure Search

SMILES

CCOC(=O)C1=C(O)N=C2C(C)=CC(NC3=CC=C(C)C=C3)=C4C(=O)C5=C(C=CC=C5)C1=C24

InChI

InChIKey=YNTVBEBKDUKDRV-UHFFFAOYSA-N

InChI=1S/C27H22N2O4/c1-4-33-27(32)23-20-17-7-5-6-8-18(17)25(30)21-19(28-16-11-9-14(2)10-12-16)13-15(3)24(22(20)21)29-26(23)31/h5-13,28H,4H2,1-3H3,(H,29,31)

HIDE SMILES / InChI

Molecular Formula	C27H22N2O4
Molecular Weight	438.4746
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:33:21 GMT 2023` Edited by `admin` on `Sat Dec 16 12:33:21 GMT 2023`
Record UNII	9BU78YKC5S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3H-Naphtho[1,2,3-de]quinoline-1-carboxylic acid, 2,7-dihydro-4-methyl-6-[(4-methylphenyl)amino]-2,7-dioxo-, ethyl ester

Systematic Name

English

Ethyl 2,7-dihydro-4-methyl-6-[(4-methylphenyl)amino]-2,7-dioxo-3H-naphtho[1,2,3-de]quinoline-1-carboxylate

Systematic Name

English

Code System Code Type Description

CAS

68833-64-7