(E)-3-(4-nitrophenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]prop-2-enamide Openeye Name: (E)-3-(4-nitrophenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]-2-propenamide IUPAC Name: (E)-3-(4-nitrophenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]prop-2-enamide Traditional Name: (E)-3-(4-nitrophenyl)-N-[3-(4-phenylpiperazino)propyl]acrylamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCNC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O3/c27-22(12-9-19-7-10-21(11-8-19)26(28)29)23-13-4-14-24-15-17-25(18-16-24)20-5-2-1-3-6-20/h1-3,5-12H,4,13-18H2,(H,23,27)/b12-9+