[(Z)-(2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 2-bromanyl-3-nitro-benzoate

Systemtic Name: [(Z)-(2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 2-bromanyl-3-nitro-benzoate Openeye Name: [(Z)-(5-isopropyl-2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 2-bromo-3-nitro-benzoate CAS Name: 2-bromo-3-nitrobenzoic acid [(Z)-(2-methyl-4-oxo-5-propan-2-yl-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(Z)-(2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene)amino] 2-bromo-3-nitrobenzoate Traditional Name: 2-bromo-3-nitro-benzoic acid [(Z)-(5-isopropyl-4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C17H15BrN2O5 MolecularWeight: 407.2154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=CC1=NOC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])Br)C(C)C

Isomeric SMILES

CC\1=CC(=O)C(=C/C1=N/OC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])Br)C(C)C

InChI

InChI=1S/C17H15BrN2O5/c1-9(2)12-8-13(10(3)7-15(12)21)19-25-17(22)11-5-4-6-14(16(11)18)20(23)24/h4-9H,1-3H3/b19-13-