3-chloranyl-12-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid

Systemtic Name: 3-chloranyl-12-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid Openeye Name: 3-chloro-12-cyclohexyl-5-[2-(1-piperidyl)ethyl]-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid CAS Name: 3-chloro-12-cyclohexyl-5-[2-(1-piperidinyl)ethyl]-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid IUPAC Name: 3-chloro-12-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid Traditional Name: 3-chloro-12-cyclohexyl-5-(2-piperidinoethyl)-6,7-dihydroindolo[3,2-d][1]benzazepine-9-carboxylic acid Formula: C30H36ClN3O2 MolecularWeight: 506.07874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)C4=C2C5=C(C=C(C=C5)Cl)N(CC4)CCN6CCCCC6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)C4=C2C5=C(C=C(C=C5)Cl)N(CC4)CCN6CCCCC6

InChI

InChI=1S/C30H36ClN3O2/c31-22-10-11-25-28(20-22)33(18-17-32-14-5-2-6-15-32)16-13-24-26-19-21(30(35)36)9-12-27(26)34(29(24)25)23-7-3-1-4-8-23/h9-12,19-20,23H,1-8,13-18H2,(H,35,36)