1-[4-(aminomethyl)-4-oxidanyl-piperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone

Systemtic Name: 1-[4-(aminomethyl)-4-oxidanyl-piperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone Openeye Name: 1-[4-(aminomethyl)-4-hydroxy-1-piperidyl]-2-(3,4-dimethoxyphenyl)ethanone CAS Name: 1-[4-(aminomethyl)-4-hydroxy-1-piperidinyl]-2-(3,4-dimethoxyphenyl)ethanone IUPAC Name: 1-[4-(aminomethyl)-4-hydroxypiperidin-1-yl]-2-(3,4-dimethoxyphenyl)ethanone Traditional Name: 1-[4-(aminomethyl)-4-hydroxy-piperidino]-2-(3,4-dimethoxyphenyl)ethanone Formula: C16H24N2O4 MolecularWeight: 308.37276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)(CN)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCC(CC2)(CN)O)OC

InChI

InChI=1S/C16H24N2O4/c1-21-13-4-3-12(9-14(13)22-2)10-15(19)18-7-5-16(20,11-17)6-8-18/h3-4,9,20H,5-8,10-11,17H2,1-2H3