(1R,3S,4S,5R)-4-[[(2-methoxyphenyl)amino]methyl]-6,6-dimethyl-bicyclo[3.1.1]heptane-3,4-diol

Systemtic Name: (1R,3S,4S,5R)-4-[[(2-methoxyphenyl)amino]methyl]-6,6-dimethyl-bicyclo[3.1.1]heptane-3,4-diol Openeye Name: (1R,2S,3S,5R)-2-[(2-methoxyanilino)methyl]-6,6-dimethyl-norpinane-2,3-diol CAS Name: (1R,3S,4S,5R)-4-[(2-methoxyanilino)methyl]-6,6-dimethylbicyclo[3.1.1]heptane-3,4-diol IUPAC Name: (1R,3S,4S,5R)-4-[(2-methoxyanilino)methyl]-6,6-dimethylbicyclo[3.1.1]heptane-3,4-diol Traditional Name: (1R,2S,3S,5R)-6,6-dimethyl-2-(o-anisidinomethyl)norpinane-2,3-diol Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC1C(C(C2)O)(CNC3=CC=CC=C3OC)O)C

Isomeric SMILES

CC1([C@@H]2C[C@H]1[C@@]([C@H](C2)O)(CNC3=CC=CC=C3OC)O)C

InChI

InChI=1S/C17H25NO3/c1-16(2)11-8-14(16)17(20,15(19)9-11)10-18-12-6-4-5-7-13(12)21-3/h4-7,11,14-15,18-20H,8-10H2,1-3H3/t11-,14-,15+,17-/m1/s1