[4-[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-(1-benzyl-2,3-dimethyl-indole-5-carbonyl)piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[2,3-dimethyl-1-(phenylmethyl)-5-indolyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(1-benzyl-2,3-dimethylindole-5-carbonyl)piperazin-1-yl]-phenylmethanone Traditional Name: [4-(1-benzyl-2,3-dimethyl-indole-5-carbonyl)piperazino]-phenyl-methanone Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)CC5=CC=CC=C5)C

InChI

InChI=1S/C29H29N3O2/c1-21-22(2)32(20-23-9-5-3-6-10-23)27-14-13-25(19-26(21)27)29(34)31-17-15-30(16-18-31)28(33)24-11-7-4-8-12-24/h3-14,19H,15-18,20H2,1-2H3