methyl 3-[(3S,4R)-4-(dimethylamino)-1-(naphthalen-2-ylmethyl)piperidin-3-yl]propanoate

Systemtic Name: methyl 3-[(3S,4R)-4-(dimethylamino)-1-(naphthalen-2-ylmethyl)piperidin-3-yl]propanoate Openeye Name: methyl 3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidyl]propanoate CAS Name: 3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthalenylmethyl)-3-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(3S,4R)-4-(dimethylamino)-1-(naphthalen-2-ylmethyl)piperidin-3-yl]propanoate Traditional Name: 3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidyl]propionic acid methyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1CCC(=O)OC)CC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CN(C)[C@@H]1CCN(C[C@@H]1CCC(=O)OC)CC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H30N2O2/c1-23(2)21-12-13-24(16-20(21)10-11-22(25)26-3)15-17-8-9-18-6-4-5-7-19(18)14-17/h4-9,14,20-21H,10-13,15-16H2,1-3H3/t20-,21+/m0/s1