2-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethoxycarbonylamino)amino]-2-(4-methoxyphenyl)ethanoic acid

Systemtic Name: 2-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethoxycarbonylamino)amino]-2-(4-methoxyphenyl)ethanoic acid Openeye Name: 2-[benzyloxycarbonylamino-(2-ethoxy-2-oxo-ethyl)amino]-2-(4-methoxyphenyl)acetic acid CAS Name: 2-[(2-ethoxy-2-oxoethyl)-(phenylmethoxycarbonylamino)amino]-2-(4-methoxyphenyl)acetic acid IUPAC Name: 2-[(2-ethoxy-2-oxoethyl)-(phenylmethoxycarbonylamino)amino]-2-(4-methoxyphenyl)acetic acid Traditional Name: 2-[benzyloxycarbonylamino-(2-ethoxy-2-keto-ethyl)amino]-2-(4-methoxyphenyl)acetic acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(C1=CC=C(C=C1)OC)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN(C(C1=CC=C(C=C1)OC)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O7/c1-3-29-18(24)13-23(22-21(27)30-14-15-7-5-4-6-8-15)19(20(25)26)16-9-11-17(28-2)12-10-16/h4-12,19H,3,13-14H2,1-2H3,(H,22,27)(H,25,26)