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Details

Stereochemistry ACHIRAL
Molecular Formula C25H31N3O4
Molecular Weight 437.5313
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALPERTINE

SMILES

CCOC(=O)C1=C(CCN2CCN(CC2)C3=CC=CC=C3)C4=CC(OC)=C(OC)C=C4N1

InChI

InChIKey=RXAVJRAUFOPBOO-UHFFFAOYSA-N
InChI=1S/C25H31N3O4/c1-4-32-25(29)24-19(20-16-22(30-2)23(31-3)17-21(20)26-24)10-11-27-12-14-28(15-13-27)18-8-6-5-7-9-18/h5-9,16-17,26H,4,10-15H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C25H31N3O4
Molecular Weight 437.5313
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Alpertine is an antipsychotic agent.

Approval Year

Substance Class Chemical
Record UNII
KYT38QTB4K
Record Status Validated (UNII)
Record Version