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

Systemtic Name: (E)-2-(6-methoxy-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(6-methoxy-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile CAS Name: (E)-2-(6-methoxy-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)-2-pyrrolyl]-2-propenenitrile IUPAC Name: (E)-2-(6-methoxy-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(6-methoxy-1H-benzimidazol-2-yl)-3-[1-(3-nitrophenyl)pyrrol-2-yl]acrylonitrile Formula: C21H15N5O3 MolecularWeight: 385.3755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC=CN3C4=CC(=CC=C4)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H15N5O3/c1-29-18-7-8-19-20(12-18)24-21(23-19)14(13-22)10-15-6-3-9-25(15)16-4-2-5-17(11-16)26(27)28/h2-12H,1H3,(H,23,24)/b14-10+