2-[2-[[2-(2-azanyl-2-oxidanylidene-ethyl)phenyl]methylamino]-1-oxidanyl-ethyl]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-(2-azanyl-2-oxidanylidene-ethyl)phenyl]methylamino]-1-oxidanyl-ethyl]-3-methyl-pentanoic acid Openeye Name: 2-[2-[[2-(2-amino-2-oxo-ethyl)phenyl]methylamino]-1-hydroxy-ethyl]-3-methyl-pentanoic acid CAS Name: 2-[2-[[2-(2-amino-2-oxoethyl)phenyl]methylamino]-1-hydroxyethyl]-3-methylpentanoic acid IUPAC Name: 2-[2-[[2-(2-amino-2-oxoethyl)phenyl]methylamino]-1-hydroxyethyl]-3-methylpentanoic acid Traditional Name: 2-[2-[[2-(2-amino-2-keto-ethyl)benzyl]amino]-1-hydroxy-ethyl]-3-methyl-valeric acid Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(CNCC1=CC=CC=C1CC(=O)N)O)C(=O)O

Isomeric SMILES

CCC(C)C(C(CNCC1=CC=CC=C1CC(=O)N)O)C(=O)O

InChI

InChI=1S/C17H26N2O4/c1-3-11(2)16(17(22)23)14(20)10-19-9-13-7-5-4-6-12(13)8-15(18)21/h4-7,11,14,16,19-20H,3,8-10H2,1-2H3,(H2,18,21)(H,22,23)