(3,4-dimethoxyphenyl)-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: (3,4-dimethoxyphenyl)-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: (3,4-dimethoxyphenyl)-[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]azanium Traditional Name: (3,4-dimethoxyphenyl)-[2-[(2S)-2-ethylpiperidino]-2-keto-ethyl]ammonium Formula: C17H27N2O3+ MolecularWeight: 307.40788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C[NH2+]C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)C[NH2+]C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H26N2O3/c1-4-14-7-5-6-10-19(14)17(20)12-18-13-8-9-15(21-2)16(11-13)22-3/h8-9,11,14,18H,4-7,10,12H2,1-3H3/p+1/t14-/m0/s1