[2-oxidanyl-3-(propan-2-ylamino)propyl] 2-chloranylbenzoate hydrochloride

Systemtic Name: [2-oxidanyl-3-(propan-2-ylamino)propyl] 2-chloranylbenzoate hydrochloride Openeye Name: [2-hydroxy-3-(isopropylamino)propyl] 2-chlorobenzoate hydrochloride CAS Name: 2-chlorobenzoic acid [2-hydroxy-3-(propan-2-ylamino)propyl] ester hydrochloride IUPAC Name: [2-hydroxy-3-(propan-2-ylamino)propyl] 2-chlorobenzoate hydrochloride Traditional Name: 2-chlorobenzoic acid [2-hydroxy-3-(isopropylamino)propyl] ester hydrochloride Formula: C13H19Cl2NO3 MolecularWeight: 308.20086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC(=O)C1=CC=CC=C1Cl)O.Cl

Isomeric SMILES

CC(C)NCC(COC(=O)C1=CC=CC=C1Cl)O.Cl

InChI

InChI=1S/C13H18ClNO3.ClH/c1-9(2)15-7-10(16)8-18-13(17)11-5-3-4-6-12(11)14;/h3-6,9-10,15-16H,7-8H2,1-2H3;1H