[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate Openeye Name: [2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl] 3-bromo-5-ethoxy-4-methoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-methoxybenzoic acid [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 3-bromo-5-ethoxy-4-methoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-methoxy-benzoic acid [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl] ester Formula: C16H22BrNO5 MolecularWeight: 388.25358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OC)OCC

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO5/c1-5-10(3)18-14(19)9-23-16(20)11-7-12(17)15(21-4)13(8-11)22-6-2/h7-8,10H,5-6,9H2,1-4H3,(H,18,19)/t10-/m0/s1