N-methyl-N-[2-(3-methylpyrrolidin-1-yl)-1-phenyl-ethyl]-2-(3-nitro-4-phenylmethoxy-phenyl)ethanamide

Systemtic Name: N-methyl-N-[2-(3-methylpyrrolidin-1-yl)-1-phenyl-ethyl]-2-(3-nitro-4-phenylmethoxy-phenyl)ethanamide Openeye Name: 2-(4-benzyloxy-3-nitro-phenyl)-N-methyl-N-[2-(3-methylpyrrolidin-1-yl)-1-phenyl-ethyl]acetamide CAS Name: N-methyl-N-[2-(3-methyl-1-pyrrolidinyl)-1-phenylethyl]-2-(3-nitro-4-phenylmethoxyphenyl)acetamide IUPAC Name: N-methyl-N-[2-(3-methylpyrrolidin-1-yl)-1-phenylethyl]-2-(3-nitro-4-phenylmethoxyphenyl)acetamide Traditional Name: 2-(4-benzoxy-3-nitro-phenyl)-N-methyl-N-[2-(3-methylpyrrolidino)-1-phenyl-ethyl]acetamide Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)CC(C2=CC=CC=C2)N(C)C(=O)CC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(C1)CC(C2=CC=CC=C2)N(C)C(=O)CC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H33N3O4/c1-22-15-16-31(19-22)20-27(25-11-7-4-8-12-25)30(2)29(33)18-24-13-14-28(26(17-24)32(34)35)36-21-23-9-5-3-6-10-23/h3-14,17,22,27H,15-16,18-21H2,1-2H3