methyl 2-bromanyl-3-[(3-oxidanylidene-5-propan-2-yl-cyclohexen-1-yl)amino]benzoate

Systemtic Name: methyl 2-bromanyl-3-[(3-oxidanylidene-5-propan-2-yl-cyclohexen-1-yl)amino]benzoate Openeye Name: methyl 2-bromo-3-[(5-isopropyl-3-oxo-cyclohexen-1-yl)amino]benzoate CAS Name: 2-bromo-3-[(3-oxo-5-propan-2-yl-1-cyclohexenyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-3-[(3-oxo-5-propan-2-ylcyclohexen-1-yl)amino]benzoate Traditional Name: 2-bromo-3-[(5-isopropyl-3-keto-cyclohexen-1-yl)amino]benzoic acid methyl ester Formula: C17H20BrNO3 MolecularWeight: 366.2496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC(=CC(=O)C1)NC2=CC=CC(=C2Br)C(=O)OC

Isomeric SMILES

CC(C)C1CC(=CC(=O)C1)NC2=CC=CC(=C2Br)C(=O)OC

InChI

InChI=1S/C17H20BrNO3/c1-10(2)11-7-12(9-13(20)8-11)19-15-6-4-5-14(16(15)18)17(21)22-3/h4-6,9-11,19H,7-8H2,1-3H3