[(Z)-[5,6-bis(chloranyl)-2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohex-2-en-1-ylidene]amino] 3-nitrobenzoate

Systemtic Name: [(Z)-[5,6-bis(chloranyl)-2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohex-2-en-1-ylidene]amino] 3-nitrobenzoate Openeye Name: [(Z)-(5,6-dichloro-5-isopropyl-2-methyl-4-oxo-cyclohex-2-en-1-ylidene)amino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(Z)-(5,6-dichloro-2-methyl-4-oxo-5-propan-2-yl-1-cyclohex-2-enylidene)amino] ester IUPAC Name: [(Z)-(5,6-dichloro-2-methyl-4-oxo-5-propan-2-ylcyclohex-2-en-1-ylidene)amino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(Z)-(5,6-dichloro-5-isopropyl-4-keto-2-methyl-cyclohex-2-en-1-ylidene)amino] ester Formula: C17H16Cl2N2O5 MolecularWeight: 399.22534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(C1=NOC(=O)C2=CC(=CC=C2)[N+](=O)[O-])Cl)(C(C)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H16Cl2N2O5/c1-9(2)17(19)13(22)7-10(3)14(15(17)18)20-26-16(23)11-5-4-6-12(8-11)21(24)25/h4-9,15H,1-3H3/b20-14-