5-[2-(4-hydroxyphenyl)ethylamino]-3-[(2-methoxy-2-oxidanylidene-ethanoyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-(4-hydroxyphenyl)ethylamino]-3-[(2-methoxy-2-oxidanylidene-ethanoyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(4-hydroxyphenyl)ethylamino]-3-[(2-methoxy-2-oxo-acetyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[2-(4-hydroxyphenyl)ethylamino]-3-[(2-methoxy-1,2-dioxoethyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[2-(4-hydroxyphenyl)ethylamino]-3-[(2-methoxy-2-oxoacetyl)amino]-5-oxopentanoic acid Traditional Name: 5-[2-(4-hydroxyphenyl)ethylamino]-5-keto-3-(methoxalylamino)valeric acid Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)NC(CC(=O)NCCC1=CC=C(C=C1)O)CC(=O)O

Isomeric SMILES

COC(=O)C(=O)NC(CC(=O)NCCC1=CC=C(C=C1)O)CC(=O)O

InChI

InChI=1S/C16H20N2O7/c1-25-16(24)15(23)18-11(9-14(21)22)8-13(20)17-7-6-10-2-4-12(19)5-3-10/h2-5,11,19H,6-9H2,1H3,(H,17,20)(H,18,23)(H,21,22)