[4-(3-azanyl-2-methoxy-4-pyridin-3-yl-5-sulfamoyl-phenyl)phenyl] 2-azanylbenzoate

Systemtic Name: [4-(3-azanyl-2-methoxy-4-pyridin-3-yl-5-sulfamoyl-phenyl)phenyl] 2-azanylbenzoate Openeye Name: [4-[3-amino-2-methoxy-4-(3-pyridyl)-5-sulfamoyl-phenyl]phenyl] 2-aminobenzoate CAS Name: 2-aminobenzoic acid [4-[3-amino-2-methoxy-4-(3-pyridinyl)-5-sulfamoylphenyl]phenyl] ester IUPAC Name: [4-(3-amino-2-methoxy-4-pyridin-3-yl-5-sulfamoylphenyl)phenyl] 2-aminobenzoate Traditional Name: 2-aminobenzoic acid [4-[3-amino-2-methoxy-4-(3-pyridyl)-5-sulfamoyl-phenyl]phenyl] ester Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3N)S(=O)(=O)N)C4=CN=CC=C4)N

Isomeric SMILES

COC1=C(C(=C(C=C1C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3N)S(=O)(=O)N)C4=CN=CC=C4)N

InChI

InChI=1S/C25H22N4O5S/c1-33-24-19(13-21(35(28,31)32)22(23(24)27)16-5-4-12-29-14-16)15-8-10-17(11-9-15)34-25(30)18-6-2-3-7-20(18)26/h2-14H,26-27H2,1H3,(H2,28,31,32)