4-[4-[(4-carboxyphenyl)carbamoyloxy]butoxycarbonylamino]benzoic acid

Systemtic Name: 4-[4-[(4-carboxyphenyl)carbamoyloxy]butoxycarbonylamino]benzoic acid Openeye Name: 4-[4-[(4-carboxyphenyl)carbamoyloxy]butoxycarbonylamino]benzoic acid CAS Name: 4-[[4-[(4-carboxyanilino)-oxomethoxy]butoxy-oxomethyl]amino]benzoic acid IUPAC Name: 4-[4-[(4-carboxyphenyl)carbamoyloxy]butoxycarbonylamino]benzoic acid Traditional Name: 4-[4-[(4-carboxyphenyl)carbamoyloxy]butoxycarbonylamino]benzoic acid Formula: C20H20N2O8 MolecularWeight: 416.3814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)OCCCCOC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)OCCCCOC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H20N2O8/c23-17(24)13-3-7-15(8-4-13)21-19(27)29-11-1-2-12-30-20(28)22-16-9-5-14(6-10-16)18(25)26/h3-10H,1-2,11-12H2,(H,21,27)(H,22,28)(H,23,24)(H,25,26)