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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-oxidanylidene-1-(3-oxidanylpropyl)benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-(3-hydroxypropyl)-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(3-hydroxypropyl)-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(3-hydroxypropyl)-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-(3-hydroxypropyl)-2-keto-benzimidazole-5-carbonitrile Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3O3/c1-26-18-6-4-14(9-15(18)20)12-23-17-10-13(11-21)3-5-16(17)22(19(23)25)7-2-8-24/h3-6,9-10,24H,2,7-8,12H2,1H3