(E)-3-(3-nitrophenyl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-nitrophenyl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-benzyloxy-1-piperidyl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(3-nitrophenyl)-1-(4-phenylmethoxy-1-piperidinyl)-2-propen-1-one IUPAC Name: (E)-3-(3-nitrophenyl)-1-(4-phenylmethoxypiperidin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoxypiperidino)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC2=CC=CC=C2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1OCC2=CC=CC=C2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O4/c24-21(10-9-17-7-4-8-19(15-17)23(25)26)22-13-11-20(12-14-22)27-16-18-5-2-1-3-6-18/h1-10,15,20H,11-14,16H2/b10-9+