4-[[4,5-dimethyl-1-(phenylmethyl)-3,6-dihydro-2H-pyridin-6-yl]methyl]phenol; ethanedioic acid

Systemtic Name: 4-[[4,5-dimethyl-1-(phenylmethyl)-3,6-dihydro-2H-pyridin-6-yl]methyl]phenol; ethanedioic acid Openeye Name: 4-[(1-benzyl-4,5-dimethyl-3,6-dihydro-2H-pyridin-6-yl)methyl]phenol; oxalic acid CAS Name: 4-[[4,5-dimethyl-1-(phenylmethyl)-3,6-dihydro-2H-pyridin-6-yl]methyl]phenol; oxalic acid IUPAC Name: 4-[(1-benzyl-4,5-dimethyl-3,6-dihydro-2H-pyridin-6-yl)methyl]phenol; oxalic acid Traditional Name: 4-[(1-benzyl-4,5-dimethyl-3,6-dihydro-2H-pyridin-6-yl)methyl]phenol; oxalic acid Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(CC1)CC2=CC=CC=C2)CC3=CC=C(C=C3)O)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(N(CC1)CC2=CC=CC=C2)CC3=CC=C(C=C3)O)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H25NO.C2H2O4/c1-16-12-13-22(15-19-6-4-3-5-7-19)21(17(16)2)14-18-8-10-20(23)11-9-18;3-1(4)2(5)6/h3-11,21,23H,12-15H2,1-2H3;(H,3,4)(H,5,6)