3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(1-methanoylpyrrolidin-3-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(1-methanoylpyrrolidin-3-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-(1-formylpyrrolidin-3-yl)-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(1-formyl-3-pyrrolidinyl)-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(1-formylpyrrolidin-3-yl)-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-(1-formylpyrrolidin-3-yl)-2-keto-benzimidazole-5-carbonitrile Formula: C21H19ClN4O3 MolecularWeight: 410.85356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCN(C4)C=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCN(C4)C=O)Cl

InChI

InChI=1S/C21H19ClN4O3/c1-29-20-5-3-15(8-17(20)22)11-25-19-9-14(10-23)2-4-18(19)26(21(25)28)16-6-7-24(12-16)13-27/h2-5,8-9,13,16H,6-7,11-12H2,1H3