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

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[3-nitro-4-(1-piperazinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-(3-nitro-4-piperazin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-(3-nitro-4-piperazino-phenyl)acrylamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-28-17-6-2-15(3-7-17)4-9-20(25)22-16-5-8-18(19(14-16)24(26)27)23-12-10-21-11-13-23/h2-9,14,21H,10-13H2,1H3,(H,22,25)/b9-4+