3-[[2-(ethoxycarbonylamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid

Systemtic Name: 3-[[2-(ethoxycarbonylamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid Openeye Name: 3-[[2-(ethoxycarbonylamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid CAS Name: 3-[[2-(ethoxycarbonylamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid IUPAC Name: 3-[[2-(ethoxycarbonylamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid Traditional Name: 3-[[2-(carbethoxyamino)-1H-imidazo[4,5-b]pyridin-6-yl]amino]benzoic acid Formula: C16H15N5O4 MolecularWeight: 341.3214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=NC=C(C=C2N1)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CCOC(=O)NC1=NC2=NC=C(C=C2N1)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H15N5O4/c1-2-25-16(24)21-15-19-12-7-11(8-17-13(12)20-15)18-10-5-3-4-9(6-10)14(22)23/h3-8,18H,2H2,1H3,(H,22,23)(H2,17,19,20,21,24)