13-cyclohexyl-4-(1-piperidin-1-ylpentan-3-ylamino)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-4-(1-piperidin-1-ylpentan-3-ylamino)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-4-[[1-ethyl-3-(1-piperidyl)propyl]amino]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-4-[1-(1-piperidinyl)pentan-3-ylamino]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-4-(1-piperidin-1-ylpentan-3-ylamino)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-4-[(1-ethyl-3-piperidino-propyl)amino]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Formula: C33H43N3O3 MolecularWeight: 529.71282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCN1CCCCC1)NC2=CC=CC3=C2OCCN4C3=C(C5=C4C=C(C=C5)C(=O)O)C6CCCCC6

Isomeric SMILES

CCC(CCN1CCCCC1)NC2=CC=CC3=C2OCCN4C3=C(C5=C4C=C(C=C5)C(=O)O)C6CCCCC6

InChI

InChI=1S/C33H43N3O3/c1-2-25(16-19-35-17-7-4-8-18-35)34-28-13-9-12-27-31-30(23-10-5-3-6-11-23)26-15-14-24(33(37)38)22-29(26)36(31)20-21-39-32(27)28/h9,12-15,22-23,25,34H,2-8,10-11,16-21H2,1H3,(H,37,38)