(2S)-2-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-2-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-2-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2S)-2-[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-2-[(4,5-dimethoxy-2-methyl-benzyl)-methyl-amino]-1-(4-phenylpiperazino)propan-1-one Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)C(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)[C@@H](C)C(=O)N2CCN(CC2)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C24H33N3O3/c1-18-15-22(29-4)23(30-5)16-20(18)17-25(3)19(2)24(28)27-13-11-26(12-14-27)21-9-7-6-8-10-21/h6-10,15-16,19H,11-14,17H2,1-5H3/t19-/m0/s1