pentyl 3-[2-(2-methylpropylamino)ethanoylamino]benzoate hydrochloride

Systemtic Name: pentyl 3-[2-(2-methylpropylamino)ethanoylamino]benzoate hydrochloride Openeye Name: pentyl 3-[[2-(isobutylamino)acetyl]amino]benzoate hydrochloride CAS Name: 3-[[2-(2-methylpropylamino)-1-oxoethyl]amino]benzoic acid pentyl ester hydrochloride IUPAC Name: pentyl 3-[[2-(2-methylpropylamino)acetyl]amino]benzoate hydrochloride Traditional Name: 3-[[2-(isobutylamino)acetyl]amino]benzoic acid amyl ester hydrochloride Formula: C18H29ClN2O3 MolecularWeight: 356.88746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC(=CC=C1)NC(=O)CNCC(C)C.Cl

Isomeric SMILES

CCCCCOC(=O)C1=CC(=CC=C1)NC(=O)CNCC(C)C.Cl

InChI

InChI=1S/C18H28N2O3.ClH/c1-4-5-6-10-23-18(22)15-8-7-9-16(11-15)20-17(21)13-19-12-14(2)3;/h7-9,11,14,19H,4-6,10,12-13H2,1-3H3,(H,20,21);1H