ethyl 5-[[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]pentanoate hydrochloride

Systemtic Name: ethyl 5-[[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]pentanoate hydrochloride Openeye Name: ethyl 5-[[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]pentanoate hydrochloride CAS Name: 5-[[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]pentanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-[[7-(4-carbamimidoylphenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]pentanoate hydrochloride Traditional Name: 5-[[7-(4-amidinophenoxy)-5-methyl-1,8-naphthyridin-2-yl]amino]valeric acid ethyl ester hydrochloride Formula: C23H28ClN5O3 MolecularWeight: 457.95312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCNC1=NC2=C(C=C1)C(=CC(=N2)OC3=CC=C(C=C3)C(=N)N)C.Cl

Isomeric SMILES

CCOC(=O)CCCCNC1=NC2=C(C=C1)C(=CC(=N2)OC3=CC=C(C=C3)C(=N)N)C.Cl

InChI

InChI=1S/C23H27N5O3.ClH/c1-3-30-21(29)6-4-5-13-26-19-12-11-18-15(2)14-20(28-23(18)27-19)31-17-9-7-16(8-10-17)22(24)25;/h7-12,14H,3-6,13H2,1-2H3,(H3,24,25)(H,26,27,28);1H