ethyl 6-ethoxy-4-[(4-methoxyphenyl)amino]-1,5-naphthyridine-3-carboxylate hydrate hydrochloride

Systemtic Name: ethyl 6-ethoxy-4-[(4-methoxyphenyl)amino]-1,5-naphthyridine-3-carboxylate hydrate hydrochloride Openeye Name: ethyl 6-ethoxy-4-(4-methoxyanilino)-1,5-naphthyridine-3-carboxylate hydrate hydrochloride CAS Name: 6-ethoxy-4-(4-methoxyanilino)-1,5-naphthyridine-3-carboxylic acid ethyl ester hydrate hydrochloride IUPAC Name: ethyl 6-ethoxy-4-(4-methoxyanilino)-1,5-naphthyridine-3-carboxylate hydrate hydrochloride Traditional Name: 6-ethoxy-4-(p-anisidino)-1,5-naphthyridine-3-carboxylic acid ethyl ester hydrate hydrochloride Formula: C20H24ClN3O5 MolecularWeight: 421.87466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)OC.O.Cl

Isomeric SMILES

CCOC1=NC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=CC=C(C=C3)OC.O.Cl

InChI

InChI=1S/C20H21N3O4.ClH.H2O/c1-4-26-17-11-10-16-19(23-17)18(15(12-21-16)20(24)27-5-2)22-13-6-8-14(25-3)9-7-13;;/h6-12H,4-5H2,1-3H3,(H,21,22);1H;1H2