(E)-3-(3-nitrophenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[3-nitro-4-(1-piperazinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-(3-nitro-4-piperazin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-(3-nitro-4-piperazino-phenyl)acrylamide Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5/c25-19(7-4-14-2-1-3-16(12-14)23(26)27)21-15-5-6-17(18(13-15)24(28)29)22-10-8-20-9-11-22/h1-7,12-13,20H,8-11H2,(H,21,25)/b7-4+