methyl (2R)-2-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-methyl-pentanoate CAS Name: (2R)-2-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-methylpentanoate Traditional Name: (2R)-2-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-methyl-valeric acid methyl ester Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC=C1C=C(C=CC1=O)Br

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC=C1C=C(C=CC1=O)Br

InChI

InChI=1S/C14H18BrNO3/c1-9(2)6-12(14(18)19-3)16-8-10-7-11(15)4-5-13(10)17/h4-5,7-9,12,16H,6H2,1-3H3/t12-/m1/s1