(E)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-pyridin-4-yl-prop-2-enenitrile

Systemtic Name: (E)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-pyridin-4-yl-prop-2-enenitrile Openeye Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(4-pyridyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-3-pyridin-4-yl-2-propenenitrile IUPAC Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-pyridin-4-ylprop-2-enenitrile Traditional Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(4-pyridyl)acrylonitrile Formula: C19H17N5O3 MolecularWeight: 363.36998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)/C(=C/C3=CC=NC=C3)/C#N

InChI

InChI=1S/C19H17N5O3/c20-14-16(13-15-5-7-21-8-6-15)19(25)23-11-9-22(10-12-23)17-1-3-18(4-2-17)24(26)27/h1-8,13H,9-12H2/b16-13+