1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine

Systemtic Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Openeye Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine CAS Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine IUPAC Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Traditional Name: 1-(4,5-dimethoxy-2-methyl-benzyl)-4-[(1R)-1-(3-nitrophenyl)ethyl]piperazine Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)C(C)C3=CC(=CC=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)[C@H](C)C3=CC(=CC=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H29N3O4/c1-16-12-21(28-3)22(29-4)14-19(16)15-23-8-10-24(11-9-23)17(2)18-6-5-7-20(13-18)25(26)27/h5-7,12-14,17H,8-11,15H2,1-4H3/t17-/m1/s1