13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-2-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCCN3C2=C(C4=C3C=C(C=C4)C(=O)O)C5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)OCCN3C2=C(C4=C3C=C(C=C4)C(=O)O)C5CCCCC5

InChI

InChI=1S/C24H25NO4/c1-28-17-8-10-21-19(14-17)23-22(15-5-3-2-4-6-15)18-9-7-16(24(26)27)13-20(18)25(23)11-12-29-21/h7-10,13-15H,2-6,11-12H2,1H3,(H,26,27)