3-(4-cyano-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoate

Systemtic Name: 3-(4-cyano-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoate Openeye Name: 3-(4-cyano-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propanoate CAS Name: 3-(4-cyano-1,3-dimethyl-2-pyrido[1,2-a]benzimidazolyl)propanoate IUPAC Name: 3-(4-cyano-1,3-dimethylpyrido[1,2-a]benzimidazol-2-yl)propanoate Traditional Name: 3-(4-cyano-1,3-dimethyl-pyrido[1,2-a]benzimidazol-2-yl)propionate Formula: C17H14N3O2- MolecularWeight: 292.31196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)[O-])C)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC(=O)[O-])C)C#N

InChI

InChI=1S/C17H15N3O2/c1-10-12(7-8-16(21)22)11(2)20-15-6-4-3-5-14(15)19-17(20)13(10)9-18/h3-6H,7-8H2,1-2H3,(H,21,22)/p-1