ethanedioic acid; N-[(4-methylphenyl)methyl]-1-phenyl-ethanamine

Systemtic Name: ethanedioic acid; N-[(4-methylphenyl)methyl]-1-phenyl-ethanamine Openeye Name: oxalic acid; 1-phenyl-N-(p-tolylmethyl)ethanamine CAS Name: N-[(4-methylphenyl)methyl]-1-phenylethanamine; oxalic acid IUPAC Name: N-[(4-methylphenyl)methyl]-1-phenylethanamine; oxalic acid Traditional Name: (4-methylbenzyl)-(1-phenylethyl)amine; oxalic acid Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(C)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(C)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19N.C2H2O4/c1-13-8-10-15(11-9-13)12-17-14(2)16-6-4-3-5-7-16;3-1(4)2(5)6/h3-11,14,17H,12H2,1-2H3;(H,3,4)(H,5,6)