5-[bis(4-hydroxyphenyl)methylamino]-2-(methoxycarbonylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[bis(4-hydroxyphenyl)methylamino]-2-(methoxycarbonylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 5-[bis(4-hydroxyphenyl)methylamino]-2-(methoxycarbonylamino)-5-oxo-pentanoic acid CAS Name: 5-[bis(4-hydroxyphenyl)methylamino]-2-(methoxycarbonylamino)-5-oxopentanoic acid IUPAC Name: 5-[bis(4-hydroxyphenyl)methylamino]-2-(methoxycarbonylamino)-5-oxopentanoic acid Traditional Name: 5-[bis(4-hydroxyphenyl)methylamino]-2-(carbomethoxyamino)-5-keto-valeric acid Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CCC(=O)NC(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

COC(=O)NC(CCC(=O)NC(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C20H22N2O7/c1-29-20(28)21-16(19(26)27)10-11-17(25)22-18(12-2-6-14(23)7-3-12)13-4-8-15(24)9-5-13/h2-9,16,18,23-24H,10-11H2,1H3,(H,21,28)(H,22,25)(H,26,27)