N-(2-diethylaminoethyl)-3-octyl-2-oxidanyl-benzamide hydrochloride

Systemtic Name: N-(2-diethylaminoethyl)-3-octyl-2-oxidanyl-benzamide hydrochloride Openeye Name: N-(2-diethylaminoethyl)-2-hydroxy-3-octyl-benzamide hydrochloride CAS Name: N-(2-diethylaminoethyl)-2-hydroxy-3-octylbenzamide hydrochloride IUPAC Name: N-(2-diethylaminoethyl)-2-hydroxy-3-octylbenzamide hydrochloride Traditional Name: N-(2-diethylaminoethyl)-2-hydroxy-3-octyl-benzamide hydrochloride Formula: C21H37ClN2O2 MolecularWeight: 384.98368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC(=C1O)C(=O)NCCN(CC)CC.Cl

Isomeric SMILES

CCCCCCCCC1=CC=CC(=C1O)C(=O)NCCN(CC)CC.Cl

InChI

InChI=1S/C21H36N2O2.ClH/c1-4-7-8-9-10-11-13-18-14-12-15-19(20(18)24)21(25)22-16-17-23(5-2)6-3;/h12,14-15,24H,4-11,13,16-17H2,1-3H3,(H,22,25);1H