3-(4-chlorophenyl)-3-(1-methylindol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-chlorophenyl)-3-(1-methylindol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(4-chlorophenyl)-3-(1-methylindol-3-yl)propan-1-one CAS Name: 3-(4-chlorophenyl)-3-(1-methyl-3-indolyl)-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(4-chlorophenyl)-3-(1-methylindol-3-yl)propan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-(4-chlorophenyl)-3-(1-methylindol-3-yl)propan-1-one Formula: C30H31ClN2O MolecularWeight: 471.03294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H31ClN2O/c1-32-21-28(26-9-5-6-10-29(26)32)27(24-11-13-25(31)14-12-24)20-30(34)33-17-15-23(16-18-33)19-22-7-3-2-4-8-22/h2-14,21,23,27H,15-20H2,1H3