2-[[4-[[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]phenyl]amino]ethanoic acid

Systemtic Name: 2-[[4-[[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]phenyl]amino]ethanoic acid Openeye Name: 2-[4-[[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]acetic acid CAS Name: 2-[4-[[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]acetic acid IUPAC Name: 2-[4-[[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]acetic acid Traditional Name: 2-[4-[[2-(carbomethoxyamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]acetic acid Formula: C17H16N4O7S MolecularWeight: 420.39654

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)NCC(=O)O

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)NCC(=O)O

InChI

InChI=1S/C17H16N4O7S/c1-27-17(24)21-16-19-13-7-4-11(8-14(13)20-16)28-29(25,26)12-5-2-10(3-6-12)18-9-15(22)23/h2-8,18H,9H2,1H3,(H,22,23)(H2,19,20,21,24)