(E)-3-(4-nitrophenyl)-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[[1-(phenylmethyl)piperidin-4-yl]methyl]prop-2-enamide Openeye Name: (E)-N-[(1-benzyl-4-piperidyl)methyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-[[1-(phenylmethyl)-4-piperidinyl]methyl]-2-propenamide IUPAC Name: (E)-N-[(1-benzylpiperidin-4-yl)methyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(1-benzyl-4-piperidyl)methyl]-3-(4-nitrophenyl)acrylamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3/c26-22(11-8-18-6-9-21(10-7-18)25(27)28)23-16-19-12-14-24(15-13-19)17-20-4-2-1-3-5-20/h1-11,19H,12-17H2,(H,23,26)/b11-8+