3-[1-[(2-methylphenyl)methyl]indol-3-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-[(2-methylphenyl)methyl]indol-3-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-(o-tolylmethyl)indol-3-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-[(2-methylphenyl)methyl]-3-indolyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[1-[(2-methylphenyl)methyl]indol-3-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(2-methylbenzyl)indol-3-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O/c1-23-9-5-6-10-24(23)21-32-22-25(27-13-7-8-14-28(27)32)15-16-29(33)31-19-17-30(18-20-31)26-11-3-2-4-12-26/h2-14,22H,15-21H2,1H3