2-azanylbutanedioic acid; N-[2-(3-methylphenyl)ethyl]aniline

Systemtic Name: 2-azanylbutanedioic acid; N-[2-(3-methylphenyl)ethyl]aniline Openeye Name: 2-aminobutanedioic acid; N-[2-(m-tolyl)ethyl]aniline CAS Name: 2-aminobutanedioic acid; N-[2-(3-methylphenyl)ethyl]aniline IUPAC Name: 2-aminobutanedioic acid; N-[2-(3-methylphenyl)ethyl]aniline Traditional Name: 2-aminosuccinic acid; 2-(m-tolyl)ethyl-phenyl-amine Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNC2=CC=CC=C2.C(C(C(=O)O)N)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CCNC2=CC=CC=C2.C(C(C(=O)O)N)C(=O)O

InChI

InChI=1S/C15H17N.C4H7NO4/c1-13-6-5-7-14(12-13)10-11-16-15-8-3-2-4-9-15;5-2(4(8)9)1-3(6)7/h2-9,12,16H,10-11H2,1H3;2H,1,5H2,(H,6,7)(H,8,9)