(E)-N-[6-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[6-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[6-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-3-pyridyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[6-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]-3-pyridinyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[6-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[6-[4-(4-nitrobenzyl)piperazino]-3-pyridyl]-3-phenyl-acrylamide Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C3=NC=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C3=NC=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H25N5O3/c31-25(13-8-20-4-2-1-3-5-20)27-22-9-12-24(26-18-22)29-16-14-28(15-17-29)19-21-6-10-23(11-7-21)30(32)33/h1-13,18H,14-17,19H2,(H,27,31)/b13-8+