(E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile CAS Name: (E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)-2-pyrrolyl]-2-propenenitrile IUPAC Name: (E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(6-methyl-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]acrylonitrile Formula: C21H15N5O2 MolecularWeight: 369.3761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H15N5O2/c1-14-7-8-19-20(10-14)24-21(23-19)15(13-22)11-16-6-3-9-25(16)17-4-2-5-18(12-17)26(27)28/h2-12H,1H3,(H,23,24)/b15-11+