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

Systemtic Name: 4-[1-(diethylamino)heptan-3-yloxycarbonylamino]benzoic acid hydrochloride Openeye Name: 4-[1-(2-diethylaminoethyl)pentoxycarbonylamino]benzoic acid hydrochloride CAS Name: 4-[[1-(diethylamino)heptan-3-yloxy-oxomethyl]amino]benzoic acid hydrochloride IUPAC Name: 4-[1-(diethylamino)heptan-3-yloxycarbonylamino]benzoic acid hydrochloride Traditional Name: 4-[1-(2-diethylaminoethyl)pentoxycarbonylamino]benzoic acid hydrochloride Formula: C19H31ClN2O4 MolecularWeight: 386.91344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O4.ClH/c1-4-7-8-17(13-14-21(5-2)6-3)25-19(24)20-16-11-9-15(10-12-16)18(22)23;/h9-12,17H,4-8,13-14H2,1-3H3,(H,20,24)(H,22,23);1H