2-[[2-[(3-azanyl-2-oxidanyl-butyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[(3-azanyl-2-oxidanyl-butyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[(3-amino-2-hydroxy-butyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(3-amino-2-hydroxybutyl)amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(3-amino-2-hydroxybutyl)amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[(3-amino-2-hydroxy-butyl)amino]-3-phenyl-propanoyl]amino]-4-methyl-valeric acid Formula: C19H31N3O4 MolecularWeight: 365.46714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NCC(C(C)N)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NCC(C(C)N)O

InChI

InChI=1S/C19H31N3O4/c1-12(2)9-16(19(25)26)22-18(24)15(21-11-17(23)13(3)20)10-14-7-5-4-6-8-14/h4-8,12-13,15-17,21,23H,9-11,20H2,1-3H3,(H,22,24)(H,25,26)