[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxidanylidene-ethyl] 3-methyl-2-oxidanyl-benzoate

Systemtic Name: [2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxidanylidene-ethyl] 3-methyl-2-oxidanyl-benzoate Openeye Name: [2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxo-ethyl] 2-hydroxy-3-methyl-benzoate CAS Name: 2-hydroxy-3-methylbenzoic acid [2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxoethyl] 2-hydroxy-3-methylbenzoate Traditional Name: 2-hydroxy-3-methyl-benzoic acid [2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-keto-ethyl] ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)C2=C(C(=CC=C2)C)O

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)NC(=O)COC(=O)C2=C(C(=CC=C2)C)O

InChI

InChI=1S/C19H20BrNO4/c1-3-16(13-7-9-14(20)10-8-13)21-17(22)11-25-19(24)15-6-4-5-12(2)18(15)23/h4-10,16,23H,3,11H2,1-2H3,(H,21,22)/t16-/m0/s1