ethanedioic acid; 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenyl-butan-2-ol

Systemtic Name: ethanedioic acid; 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenyl-butan-2-ol Openeye Name: 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenyl-butan-2-ol; oxalic acid CAS Name: 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenyl-2-butanol; oxalic acid IUPAC Name: 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenylbutan-2-ol; oxalic acid Traditional Name: 3-methyl-4-[methyl(phenethyl)amino]-1,2-diphenyl-butan-2-ol; oxalic acid Formula: C28H33NO5 MolecularWeight: 463.56532

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(C3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CN(C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(C3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H31NO.C2H2O4/c1-22(21-27(2)19-18-23-12-6-3-7-13-23)26(28,25-16-10-5-11-17-25)20-24-14-8-4-9-15-24;3-1(4)2(5)6/h3-17,22,28H,18-21H2,1-2H3;(H,3,4)(H,5,6)