(E)-3-(4-nitrophenyl)-1-[4-(phenylmethyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-nitrophenyl)-1-[4-(phenylmethyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzyl-1-piperidyl)-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(4-nitrophenyl)-1-[4-(phenylmethyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-benzylpiperidin-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzylpiperidino)-3-(4-nitrophenyl)prop-2-en-1-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O3/c24-21(11-8-17-6-9-20(10-7-17)23(25)26)22-14-12-19(13-15-22)16-18-4-2-1-3-5-18/h1-11,19H,12-16H2/b11-8+