(E)-N-[2-(4-methylpiperazin-1-yl)carbonylphenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-methylpiperazin-1-yl)carbonylphenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]-3-(3-nitrophenyl)acrylamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O4/c1-23-11-13-24(14-12-23)21(27)18-7-2-3-8-19(18)22-20(26)10-9-16-5-4-6-17(15-16)25(28)29/h2-10,15H,11-14H2,1H3,(H,22,26)/b10-9+