(E)-3-(3-nitrophenyl)-2-phenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-2-phenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-2-phenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-2-phenyl-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-2-phenyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-2-phenyl-N-[4-(pyrrolidinomethyl)benzyl]acrylamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3/c31-27(28-19-21-11-13-22(14-12-21)20-29-15-4-5-16-29)26(24-8-2-1-3-9-24)18-23-7-6-10-25(17-23)30(32)33/h1-3,6-14,17-18H,4-5,15-16,19-20H2,(H,28,31)/b26-18+