(Z)-3-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-[4-(4-acetylphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[4-(4-acetylphenyl)-1-piperazinyl]-3-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-[4-(4-acetylphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-[4-(4-acetylphenyl)piperazino]-3-(3-nitrophenyl)acrylonitrile Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=CC#N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)/C(=C\C#N)/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O3/c1-16(26)17-5-7-19(8-6-17)23-11-13-24(14-12-23)21(9-10-22)18-3-2-4-20(15-18)25(27)28/h2-9,15H,11-14H2,1H3/b21-9-