methyl 3-[(2S)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate

Systemtic Name: methyl 3-[(2S)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate Openeye Name: methyl 3-[(1S)-2-(2-bromo-4-methyl-anilino)-1-methyl-2-oxo-ethoxy]benzoate CAS Name: 3-[(2S)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl]oxybenzoic acid methyl ester IUPAC Name: methyl 3-[(2S)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 3-[(1S)-2-(2-bromo-4-methyl-anilino)-2-keto-1-methyl-ethoxy]benzoic acid methyl ester Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)OC2=CC=CC(=C2)C(=O)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)OC2=CC=CC(=C2)C(=O)OC)Br

InChI

InChI=1S/C18H18BrNO4/c1-11-7-8-16(15(19)9-11)20-17(21)12(2)24-14-6-4-5-13(10-14)18(22)23-3/h4-10,12H,1-3H3,(H,20,21)/t12-/m0/s1