(2S)-2-[4-[(4-hydroxyphenyl)-methyl-amino]butanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[4-[(4-hydroxyphenyl)-methyl-amino]butanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[4-(4-hydroxy-N-methyl-anilino)butanoylamino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[4-(4-hydroxy-N-methylanilino)-1-oxobutyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[4-(4-hydroxy-N-methylanilino)butanoylamino]-3-methylbutanoic acid Traditional Name: (2S)-2-[4-(4-hydroxy-N-methyl-anilino)butanoylamino]-3-methyl-butyric acid Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCCN(C)C1=CC=C(C=C1)O

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CCCN(C)C1=CC=C(C=C1)O

InChI

InChI=1S/C16H24N2O4/c1-11(2)15(16(21)22)17-14(20)5-4-10-18(3)12-6-8-13(19)9-7-12/h6-9,11,15,19H,4-5,10H2,1-3H3,(H,17,20)(H,21,22)/t15-/m0/s1