methyl 2-methyl-4-[(3-propoxycarbonylphenyl)amino]quinoline-6-carboxylate hydrochloride

Systemtic Name: methyl 2-methyl-4-[(3-propoxycarbonylphenyl)amino]quinoline-6-carboxylate hydrochloride Openeye Name: methyl 2-methyl-4-(3-propoxycarbonylanilino)quinoline-6-carboxylate hydrochloride CAS Name: 2-methyl-4-[3-[oxo(propoxy)methyl]anilino]-6-quinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-methyl-4-(3-propoxycarbonylanilino)quinoline-6-carboxylate hydrochloride Traditional Name: 2-methyl-4-(3-propoxycarbonylanilino)quinoline-6-carboxylic acid methyl ester hydrochloride Formula: C22H23ClN2O4 MolecularWeight: 414.88202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC2=CC(=NC3=C2C=C(C=C3)C(=O)OC)C.Cl

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC2=CC(=NC3=C2C=C(C=C3)C(=O)OC)C.Cl

InChI

InChI=1S/C22H22N2O4.ClH/c1-4-10-28-22(26)15-6-5-7-17(12-15)24-20-11-14(2)23-19-9-8-16(13-18(19)20)21(25)27-3;/h5-9,11-13H,4,10H2,1-3H3,(H,23,24);1H