N-[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[4-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[4-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[4-[4-(4-chlorobenzoyl)piperazino]phenyl]-3-(3-nitrophenyl)acrylamide Formula: C26H23ClN4O4 MolecularWeight: 490.93822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H23ClN4O4/c27-21-7-5-20(6-8-21)26(33)30-16-14-29(15-17-30)23-11-9-22(10-12-23)28-25(32)13-4-19-2-1-3-24(18-19)31(34)35/h1-13,18H,14-17H2,(H,28,32)