[1-oxidanylidene-1-(phenethylamino)propan-2-yl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C18H19ClN2O3 MolecularWeight: 346.80806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C18H19ClN2O3/c1-12(17(22)21-10-9-13-5-3-2-4-6-13)24-18(23)14-7-8-15(19)16(20)11-14/h2-8,11-12H,9-10,20H2,1H3,(H,21,22)