2-[[2-methylpropylcarbamoyl-[oxidanyl(propanoyl)amino]amino]methyl]-4-phenyl-butanoic acid

Systemtic Name: 2-[[2-methylpropylcarbamoyl-[oxidanyl(propanoyl)amino]amino]methyl]-4-phenyl-butanoic acid Openeye Name: 2-[[[hydroxy(propanoyl)amino]-(isobutylcarbamoyl)amino]methyl]-4-phenyl-butanoic acid CAS Name: 2-[[[hydroxy(1-oxopropyl)amino]-[(2-methylpropylamino)-oxomethyl]amino]methyl]-4-phenylbutanoic acid IUPAC Name: 2-[[[hydroxy(propanoyl)amino]-(2-methylpropylcarbamoyl)amino]methyl]-4-phenylbutanoic acid Traditional Name: 2-[[[hydroxy(propionyl)amino]-(isobutylcarbamoyl)amino]methyl]-4-phenyl-butyric acid Formula: C19H29N3O5 MolecularWeight: 379.45066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(N(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)NCC(C)C)O

Isomeric SMILES

CCC(=O)N(N(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)NCC(C)C)O

InChI

InChI=1S/C19H29N3O5/c1-4-17(23)22(27)21(19(26)20-12-14(2)3)13-16(18(24)25)11-10-15-8-6-5-7-9-15/h5-9,14,16,27H,4,10-13H2,1-3H3,(H,20,26)(H,24,25)