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

Systemtic Name: (E)-3-(3-nitrophenyl)-1-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3-nitrophenyl)-1-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-nitrophenyl)-1-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-nitrophenyl)-1-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-keto-2-piperidino-ethyl)piperazino]-3-(3-nitrophenyl)prop-2-en-1-one Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CN2CCN(CC2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O4/c25-19(8-7-17-5-4-6-18(15-17)24(27)28)23-13-11-21(12-14-23)16-20(26)22-9-2-1-3-10-22/h4-8,15H,1-3,9-14,16H2/b8-7+