5-methyl-4-[(1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl)carbamoyl]hexanoic acid

Systemtic Name: 5-methyl-4-[(1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl)carbamoyl]hexanoic acid Openeye Name: 4-[(2-anilino-1-benzyl-2-oxo-ethyl)carbamoyl]-5-methyl-hexanoic acid CAS Name: 4-[[(1-anilino-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]-5-methylhexanoic acid IUPAC Name: 4-[(1-anilino-1-oxo-3-phenylpropan-2-yl)carbamoyl]-5-methylhexanoic acid Traditional Name: 4-[(2-anilino-1-benzyl-2-keto-ethyl)carbamoyl]-5-methyl-hexanoic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)C(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O4/c1-16(2)19(13-14-21(26)27)22(28)25-20(15-17-9-5-3-6-10-17)23(29)24-18-11-7-4-8-12-18/h3-12,16,19-20H,13-15H2,1-2H3,(H,24,29)(H,25,28)(H,26,27)