4-[3-(dibutylamino)propoxycarbonyl-(2-methylpropyl)amino]benzoic acid hydrochloride

Systemtic Name: 4-[3-(dibutylamino)propoxycarbonyl-(2-methylpropyl)amino]benzoic acid hydrochloride Openeye Name: 4-[3-(dibutylamino)propoxycarbonyl-isobutyl-amino]benzoic acid hydrochloride CAS Name: 4-[[3-(dibutylamino)propoxy-oxomethyl]-(2-methylpropyl)amino]benzoic acid hydrochloride IUPAC Name: 4-[3-(dibutylamino)propoxycarbonyl-(2-methylpropyl)amino]benzoic acid hydrochloride Traditional Name: 4-[3-(dibutylamino)propoxycarbonyl-isobutyl-amino]benzoic acid hydrochloride Formula: C23H39ClN2O4 MolecularWeight: 443.01976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC(=O)N(CC(C)C)C1=CC=C(C=C1)C(=O)O.Cl

Isomeric SMILES

CCCCN(CCCC)CCCOC(=O)N(CC(C)C)C1=CC=C(C=C1)C(=O)O.Cl

InChI

InChI=1S/C23H38N2O4.ClH/c1-5-7-14-24(15-8-6-2)16-9-17-29-23(28)25(18-19(3)4)21-12-10-20(11-13-21)22(26)27;/h10-13,19H,5-9,14-18H2,1-4H3,(H,26,27);1H