3-[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[1-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[1-(2-methoxy-5-nitrophenyl)-2,5-dimethylpyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(N(C(=C3)C)C4=C(C=CC(=C4)[N+](=O)[O-])OC)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(N(C(=C3)C)C4=C(C=CC(=C4)[N+](=O)[O-])OC)C)C#N

InChI

InChI=1S/C24H21N5O3/c1-14-5-7-20-21(9-14)27-24(26-20)18(13-25)11-17-10-15(2)28(16(17)3)22-12-19(29(30)31)6-8-23(22)32-4/h5-12H,1-4H3,(H,26,27)