methyl 3-[[5-azanyl-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoate

Systemtic Name: methyl 3-[[5-azanyl-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoate Openeye Name: methyl 3-[[5-amino-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoate CAS Name: 3-[[5-amino-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[5-amino-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoate Traditional Name: 3-[[5-amino-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]amino]benzoic acid methyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NC(=N2)NC3=CC=CC(=C3)C(=O)OC)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NC(=N2)NC3=CC=CC(=C3)C(=O)OC)N

InChI

InChI=1S/C17H17N5O3/c1-24-14-8-4-7-13(10-14)22-16(18)20-17(21-22)19-12-6-3-5-11(9-12)15(23)25-2/h3-10H,1-2H3,(H3,18,19,20,21)