2-methyl-3-[(2-methyl-3-oxidanyl-3-oxidanylidene-1-phenoxy-propyl)carbamoylamino]-3-phenoxy-propanoic acid

Systemtic Name: 2-methyl-3-[(2-methyl-3-oxidanyl-3-oxidanylidene-1-phenoxy-propyl)carbamoylamino]-3-phenoxy-propanoic acid Openeye Name: 3-[(3-hydroxy-2-methyl-3-oxo-1-phenoxy-propyl)carbamoylamino]-2-methyl-3-phenoxy-propanoic acid CAS Name: 3-[[[(3-hydroxy-2-methyl-3-oxo-1-phenoxypropyl)amino]-oxomethyl]amino]-2-methyl-3-phenoxypropanoic acid IUPAC Name: 3-[(3-hydroxy-2-methyl-3-oxo-1-phenoxypropyl)carbamoylamino]-2-methyl-3-phenoxypropanoic acid Traditional Name: 3-[(3-hydroxy-3-keto-2-methyl-1-phenoxy-propyl)carbamoylamino]-2-methyl-3-phenoxy-propionic acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(NC(=O)NC(C(C)C(=O)O)OC1=CC=CC=C1)OC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C(NC(=O)NC(C(C)C(=O)O)OC1=CC=CC=C1)OC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H24N2O7/c1-13(19(24)25)17(29-15-9-5-3-6-10-15)22-21(28)23-18(14(2)20(26)27)30-16-11-7-4-8-12-16/h3-14,17-18H,1-2H3,(H,24,25)(H,26,27)(H2,22,23,28)