[(4-carbamimidoylphenyl)amino] 2-[4-(2-dimethylaminoethyloxy)-3-ethoxy-phenyl]ethanoate hydrochloride

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[4-(2-dimethylaminoethyloxy)-3-ethoxy-phenyl]ethanoate hydrochloride Openeye Name: (4-carbamimidoylanilino) 2-[4-(2-dimethylaminoethyloxy)-3-ethoxy-phenyl]acetate hydrochloride CAS Name: 2-[4-(2-dimethylaminoethyloxy)-3-ethoxyphenyl]acetic acid (4-carbamimidoylanilino) ester hydrochloride IUPAC Name: (4-carbamimidoylanilino) 2-[4-(2-dimethylaminoethyloxy)-3-ethoxyphenyl]acetate hydrochloride Traditional Name: 2-[4-(2-dimethylaminoethyloxy)-3-ethoxy-phenyl]acetic acid (4-amidinoanilino) ester hydrochloride Formula: C21H29ClN4O4 MolecularWeight: 436.93236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCN(C)C.Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC(=O)ONC2=CC=C(C=C2)C(=N)N)OCCN(C)C.Cl

InChI

InChI=1S/C21H28N4O4.ClH/c1-4-27-19-13-15(5-10-18(19)28-12-11-25(2)3)14-20(26)29-24-17-8-6-16(7-9-17)21(22)23;/h5-10,13,24H,4,11-12,14H2,1-3H3,(H3,22,23);1H