[3-[2-(methylamino)-1-oxidanyl-ethyl]phenyl] 2-methylbenzoate hydrochloride

Systemtic Name: [3-[2-(methylamino)-1-oxidanyl-ethyl]phenyl] 2-methylbenzoate hydrochloride Openeye Name: [3-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2-methylbenzoate hydrochloride CAS Name: 2-methylbenzoic acid [3-[1-hydroxy-2-(methylamino)ethyl]phenyl] ester hydrochloride IUPAC Name: [3-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2-methylbenzoate hydrochloride Traditional Name: 2-methylbenzoic acid [3-[1-hydroxy-2-(methylamino)ethyl]phenyl] ester hydrochloride Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC=CC(=C2)C(CNC)O.Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC=CC(=C2)C(CNC)O.Cl

InChI

InChI=1S/C17H19NO3.ClH/c1-12-6-3-4-9-15(12)17(20)21-14-8-5-7-13(10-14)16(19)11-18-2;/h3-10,16,18-19H,11H2,1-2H3;1H