2-(pyridin-3-ylcarbonylamino)ethyl 2-(4-chloranyl-3-methyl-phenoxy)ethanoate hydrochloride

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl 2-(4-chloranyl-3-methyl-phenoxy)ethanoate hydrochloride Openeye Name: 2-(pyridine-3-carbonylamino)ethyl 2-(4-chloro-3-methyl-phenoxy)acetate hydrochloride CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester hydrochloride IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl 2-(4-chloro-3-methylphenoxy)acetate hydrochloride Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid 2-nicotinamidoethyl ester hydrochloride Formula: C17H18Cl2N2O4 MolecularWeight: 385.24182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OCCNC(=O)C2=CN=CC=C2)Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OCCNC(=O)C2=CN=CC=C2)Cl.Cl

InChI

InChI=1S/C17H17ClN2O4.ClH/c1-12-9-14(4-5-15(12)18)24-11-16(21)23-8-7-20-17(22)13-3-2-6-19-10-13;/h2-6,9-10H,7-8,11H2,1H3,(H,20,22);1H