2-diethylaminoethyl 2-[(4-chlorophenyl)amino]pyridine-3-carboxylate hydrochloride

Systemtic Name: 2-diethylaminoethyl 2-[(4-chlorophenyl)amino]pyridine-3-carboxylate hydrochloride Openeye Name: 2-diethylaminoethyl 2-(4-chloroanilino)pyridine-3-carboxylate hydrochloride CAS Name: 2-(4-chloroanilino)-3-pyridinecarboxylic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 2-(4-chloroanilino)pyridine-3-carboxylate hydrochloride Traditional Name: 2-(4-chloroanilino)nicotinic acid 2-diethylaminoethyl ester hydrochloride Formula: C18H23Cl2N3O2 MolecularWeight: 384.30012

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=C(N=CC=C1)NC2=CC=C(C=C2)Cl.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=C(N=CC=C1)NC2=CC=C(C=C2)Cl.Cl

InChI

InChI=1S/C18H22ClN3O2.ClH/c1-3-22(4-2)12-13-24-18(23)16-6-5-11-20-17(16)21-15-9-7-14(19)8-10-15;/h5-11H,3-4,12-13H2,1-2H3,(H,20,21);1H