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

Systemtic Name: 13-cyclohexyl-4-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-4-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-4-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-4-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-4-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=CC=CC2=C1OCCN3C2=C(C4=C3C=C(C=C4)C(=O)O)C5CCCCC5

Isomeric SMILES

COC1=CC=CC2=C1OCCN3C2=C(C4=C3C=C(C=C4)C(=O)O)C5CCCCC5

InChI

InChI=1S/C24H25NO4/c1-28-20-9-5-8-18-22-21(15-6-3-2-4-7-15)17-11-10-16(24(26)27)14-19(17)25(22)12-13-29-23(18)20/h5,8-11,14-15H,2-4,6-7,12-13H2,1H3,(H,26,27)