5-chloranyl-3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]-1-(phenylmethyl)indole

Systemtic Name: 5-chloranyl-3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]-1-(phenylmethyl)indole Openeye Name: 1-benzyl-5-chloro-3-[[4-(2,6-dimethylphenyl)-1-piperidyl]methyl]indole CAS Name: 5-chloro-3-[[4-(2,6-dimethylphenyl)-1-piperidinyl]methyl]-1-(phenylmethyl)indole IUPAC Name: 1-benzyl-5-chloro-3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]indole Traditional Name: 1-benzyl-5-chloro-3-[[4-(2,6-dimethylphenyl)piperidino]methyl]indole Formula: C29H31ClN2 MolecularWeight: 443.02284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2CCN(CC2)CC3=CN(C4=C3C=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2CCN(CC2)CC3=CN(C4=C3C=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C29H31ClN2/c1-21-7-6-8-22(2)29(21)24-13-15-31(16-14-24)19-25-20-32(18-23-9-4-3-5-10-23)28-12-11-26(30)17-27(25)28/h3-12,17,20,24H,13-16,18-19H2,1-2H3