4-[[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(6-methyl-1H-benzimidazol-2-yl)anilino]-4-oxo-butanoate CAS Name: 4-[4-(6-methyl-1H-benzimidazol-2-yl)anilino]-4-oxobutanoate IUPAC Name: 4-[4-(6-methyl-1H-benzimidazol-2-yl)anilino]-4-oxobutanoate Traditional Name: 4-keto-4-[4-(6-methyl-1H-benzimidazol-2-yl)anilino]butyrate Formula: C18H16N3O3- MolecularWeight: 322.33794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-11-2-7-14-15(10-11)21-18(20-14)12-3-5-13(6-4-12)19-16(22)8-9-17(23)24/h2-7,10H,8-9H2,1H3,(H,19,22)(H,20,21)(H,23,24)/p-1