3-(4-methoxyphenyl)-3-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)-3-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-(4-methoxyphenyl)-3-[[3-(2-methylpropanoylamino)benzoyl]amino]propanoic acid CAS Name: 3-(4-methoxyphenyl)-3-[[[3-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-methoxyphenyl)-3-[[3-(2-methylpropanoylamino)benzoyl]amino]propanoic acid Traditional Name: 3-[[3-(isobutyrylamino)benzoyl]amino]-3-(4-methoxyphenyl)propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H24N2O5/c1-13(2)20(26)22-16-6-4-5-15(11-16)21(27)23-18(12-19(24)25)14-7-9-17(28-3)10-8-14/h4-11,13,18H,12H2,1-3H3,(H,22,26)(H,23,27)(H,24,25)