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

Systemtic Name: (E)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-3-pyridin-3-yl-prop-2-enenitrile Openeye Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(3-pyridyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-3-(3-pyridinyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-pyridin-3-ylprop-2-enenitrile Traditional Name: (E)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]-3-(3-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=CN=CC=C3)C#N

Isomeric SMILES

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

InChI

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