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

Systemtic Name: ethanedioic acid; 3-methyl-4-[methyl(phenethyl)amino]-1-phenyl-2-(phenylmethyl)butan-2-ol Openeye Name: 2-benzyl-3-methyl-4-[methyl(phenethyl)amino]-1-phenyl-butan-2-ol; oxalic acid CAS Name: 3-methyl-4-[methyl(phenethyl)amino]-1-phenyl-2-(phenylmethyl)-2-butanol; oxalic acid IUPAC Name: 2-benzyl-3-methyl-4-[methyl(phenethyl)amino]-1-phenylbutan-2-ol; oxalic acid Traditional Name: 2-benzyl-3-methyl-4-[methyl(phenethyl)amino]-1-phenyl-butan-2-ol; oxalic acid Formula: C29H35NO5 MolecularWeight: 477.5919

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CN(C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H33NO.C2H2O4/c1-23(22-28(2)19-18-24-12-6-3-7-13-24)27(29,20-25-14-8-4-9-15-25)21-26-16-10-5-11-17-26;3-1(4)2(5)6/h3-17,23,29H,18-22H2,1-2H3;(H,3,4)(H,5,6)