3-(4-methylphenyl)-3-[[3-methyl-2-(propan-2-yloxycarbonylamino)butanoyl]amino]propanoic acid

Systemtic Name: 3-(4-methylphenyl)-3-[[3-methyl-2-(propan-2-yloxycarbonylamino)butanoyl]amino]propanoic acid Openeye Name: 3-[[2-(isopropoxycarbonylamino)-3-methyl-butanoyl]amino]-3-(p-tolyl)propanoic acid CAS Name: 3-[[3-methyl-1-oxo-2-[[oxo(propan-2-yloxy)methyl]amino]butyl]amino]-3-(4-methylphenyl)propanoic acid IUPAC Name: 3-(4-methylphenyl)-3-[[3-methyl-2-(propan-2-yloxycarbonylamino)butanoyl]amino]propanoic acid Traditional Name: 3-[[2-(isopropoxycarbonylamino)-3-methyl-butanoyl]amino]-3-(p-tolyl)propionic acid Formula: C19H28N2O5 MolecularWeight: 364.43602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C(C(C)C)NC(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C(C(C)C)NC(=O)OC(C)C

InChI

InChI=1S/C19H28N2O5/c1-11(2)17(21-19(25)26-12(3)4)18(24)20-15(10-16(22)23)14-8-6-13(5)7-9-14/h6-9,11-12,15,17H,10H2,1-5H3,(H,20,24)(H,21,25)(H,22,23)