2-[2-[[(2S)-3-(4-hydroxyphenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[[(2S)-3-(4-hydroxyphenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl]benzoic acid Openeye Name: 2-[2-[[(1S)-1-[(4-hydroxyphenyl)methyl]-2-methoxy-2-oxo-ethyl]carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[[[(2S)-3-(4-hydroxyphenyl)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[[(2S)-3-(4-hydroxyphenyl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[[(1S)-1-(4-hydroxybenzyl)-2-keto-2-methoxy-ethyl]carbamoyl]phenyl]benzoic acid Formula: C24H21NO6 MolecularWeight: 419.42664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)O

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H21NO6/c1-31-24(30)21(14-15-10-12-16(26)13-11-15)25-22(27)19-8-4-2-6-17(19)18-7-3-5-9-20(18)23(28)29/h2-13,21,26H,14H2,1H3,(H,25,27)(H,28,29)/t21-/m0/s1