4-[1-(dibutylamino)heptan-3-yloxycarbonylamino]benzoic acid hydrochloride

Systemtic Name: 4-[1-(dibutylamino)heptan-3-yloxycarbonylamino]benzoic acid hydrochloride Openeye Name: 4-[1-[2-(dibutylamino)ethyl]pentoxycarbonylamino]benzoic acid hydrochloride CAS Name: 4-[[1-(dibutylamino)heptan-3-yloxy-oxomethyl]amino]benzoic acid hydrochloride IUPAC Name: 4-[1-(dibutylamino)heptan-3-yloxycarbonylamino]benzoic acid hydrochloride Traditional Name: 4-[1-[2-(dibutylamino)ethyl]pentoxycarbonylamino]benzoic acid hydrochloride Formula: C23H39ClN2O4 MolecularWeight: 443.01976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCN(CCCC)CCCC)OC(=O)NC1=CC=C(C=C1)C(=O)O.Cl

Isomeric SMILES

CCCCC(CCN(CCCC)CCCC)OC(=O)NC1=CC=C(C=C1)C(=O)O.Cl

InChI

InChI=1S/C23H38N2O4.ClH/c1-4-7-10-21(15-18-25(16-8-5-2)17-9-6-3)29-23(28)24-20-13-11-19(12-14-20)22(26)27;/h11-14,21H,4-10,15-18H2,1-3H3,(H,24,28)(H,26,27);1H