tert-butyl 2-[[2-methylpropylcarbamoyl-[oxidanyl(propanoyl)amino]amino]methyl]-4-phenyl-butanoate

Systemtic Name: tert-butyl 2-[[2-methylpropylcarbamoyl-[oxidanyl(propanoyl)amino]amino]methyl]-4-phenyl-butanoate Openeye Name: tert-butyl 2-[[[hydroxy(propanoyl)amino]-(isobutylcarbamoyl)amino]methyl]-4-phenyl-butanoate CAS Name: 2-[[[hydroxy(1-oxopropyl)amino]-[(2-methylpropylamino)-oxomethyl]amino]methyl]-4-phenylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[[hydroxy(propanoyl)amino]-(2-methylpropylcarbamoyl)amino]methyl]-4-phenylbutanoate Traditional Name: 2-[[[hydroxy(propionyl)amino]-(isobutylcarbamoyl)amino]methyl]-4-phenyl-butyric acid tert-butyl ester Formula: C23H37N3O5 MolecularWeight: 435.55698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H37N3O5/c1-7-20(27)26(30)25(22(29)24-15-17(2)3)16-19(21(28)31-23(4,5)6)14-13-18-11-9-8-10-12-18/h8-12,17,19,30H,7,13-16H2,1-6H3,(H,24,29)