3-azanyl-2-[2,2-dimethyl-4-(phenylmethyl)oxan-4-yl]propan-1-ol; ethanedioic acid

Systemtic Name: 3-azanyl-2-[2,2-dimethyl-4-(phenylmethyl)oxan-4-yl]propan-1-ol; ethanedioic acid Openeye Name: 3-amino-2-(4-benzyl-2,2-dimethyl-tetrahydropyran-4-yl)propan-1-ol; oxalic acid CAS Name: 3-amino-2-[2,2-dimethyl-4-(phenylmethyl)-4-oxanyl]-1-propanol; oxalic acid IUPAC Name: 3-amino-2-(4-benzyl-2,2-dimethyloxan-4-yl)propan-1-ol; oxalic acid Traditional Name: 3-amino-2-(4-benzyl-2,2-dimethyl-tetrahydropyran-4-yl)propan-1-ol; oxalic acid Formula: C19H29NO6 MolecularWeight: 367.43666

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CC2=CC=CC=C2)C(CN)CO)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1(CC(CCO1)(CC2=CC=CC=C2)C(CN)CO)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27NO2.C2H2O4/c1-16(2)13-17(8-9-20-16,15(11-18)12-19)10-14-6-4-3-5-7-14;3-1(4)2(5)6/h3-7,15,19H,8-13,18H2,1-2H3;(H,3,4)(H,5,6)