methyl (E)-2-[(4-bromanyl-3-methyl-phenyl)amino]-5,5-dimethyl-4-oxidanylidene-hex-2-enoate

Systemtic Name: methyl (E)-2-[(4-bromanyl-3-methyl-phenyl)amino]-5,5-dimethyl-4-oxidanylidene-hex-2-enoate Openeye Name: methyl (E)-2-(4-bromo-3-methyl-anilino)-5,5-dimethyl-4-oxo-hex-2-enoate CAS Name: (E)-2-(4-bromo-3-methylanilino)-5,5-dimethyl-4-oxo-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-2-(4-bromo-3-methylanilino)-5,5-dimethyl-4-oxohex-2-enoate Traditional Name: (E)-2-(4-bromo-3-methyl-anilino)-4-keto-5,5-dimethyl-hex-2-enoic acid methyl ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=CC(=C1)N/C(=C/C(=O)C(C)(C)C)/C(=O)OC)Br

InChI

InChI=1S/C16H20BrNO3/c1-10-8-11(6-7-12(10)17)18-13(15(20)21-5)9-14(19)16(2,3)4/h6-9,18H,1-5H3/b13-9+