2-[2-(phenylmethoxycarbonylamino)ethyl]benzene-1,3,5-tricarboxylic acid

Systemtic Name: 2-[2-(phenylmethoxycarbonylamino)ethyl]benzene-1,3,5-tricarboxylic acid Openeye Name: 2-[2-(benzyloxycarbonylamino)ethyl]benzene-1,3,5-tricarboxylic acid CAS Name: 2-[2-(phenylmethoxycarbonylamino)ethyl]benzene-1,3,5-tricarboxylic acid IUPAC Name: 2-[2-(phenylmethoxycarbonylamino)ethyl]benzene-1,3,5-tricarboxylic acid Traditional Name: 2-[2-(benzyloxycarbonylamino)ethyl]trimesic acid Formula: C19H17NO8 MolecularWeight: 387.34018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC2=C(C=C(C=C2C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC2=C(C=C(C=C2C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C19H17NO8/c21-16(22)12-8-14(17(23)24)13(15(9-12)18(25)26)6-7-20-19(27)28-10-11-4-2-1-3-5-11/h1-5,8-9H,6-7,10H2,(H,20,27)(H,21,22)(H,23,24)(H,25,26)