1-(4-methylphenyl)ethanamine; 2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: 1-(4-methylphenyl)ethanamine; 2-oxidanyl-4-phenyl-butanoic acid Openeye Name: 2-hydroxy-4-phenyl-butanoic acid; 1-(p-tolyl)ethanamine CAS Name: 2-hydroxy-4-phenylbutanoic acid; 1-(4-methylphenyl)ethanamine IUPAC Name: 2-hydroxy-4-phenylbutanoic acid; 1-(4-methylphenyl)ethanamine Traditional Name: 2-hydroxy-4-phenyl-butyric acid; 1-(p-tolyl)ethylamine Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)N.C1=CC=C(C=C1)CCC(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C)N.C1=CC=C(C=C1)CCC(C(=O)O)O

InChI

InChI=1S/C10H12O3.C9H13N/c11-9(10(12)13)7-6-8-4-2-1-3-5-8;1-7-3-5-9(6-4-7)8(2)10/h1-5,9,11H,6-7H2,(H,12,13);3-6,8H,10H2,1-2H3