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

Systemtic Name: (E)-3-(3-nitrophenyl)-1-[4-(phenylmethyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzyl-1-piperidyl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(3-nitrophenyl)-1-[4-(phenylmethyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-1-(4-benzylpiperidin-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzylpiperidino)-3-(3-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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3/c24-21(10-9-18-7-4-8-20(16-18)23(25)26)22-13-11-19(12-14-22)15-17-5-2-1-3-6-17/h1-10,16,19H,11-15H2/b10-9+