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

Systemtic Name: (E)-3-(1H-indol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(1H-indol-3-yl)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]prop-2-enenitrile CAS Name: (E)-3-(1H-indol-3-yl)-2-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(1H-indol-3-yl)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]prop-2-enenitrile Traditional Name: (E)-3-(1H-indol-3-yl)-2-[4-(4-nitrophenyl)piperazine-1-carbonyl]acrylonitrile Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=CC3=CNC4=CC=CC=C43)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)/C(=C/C3=CNC4=CC=CC=C43)/C#N

InChI

InChI=1S/C22H19N5O3/c23-14-16(13-17-15-24-21-4-2-1-3-20(17)21)22(28)26-11-9-25(10-12-26)18-5-7-19(8-6-18)27(29)30/h1-8,13,15,24H,9-12H2/b16-13+