[(E)-(3-chloranyl-2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate

Systemtic Name: [(E)-(3-chloranyl-2-methyl-4-oxidanylidene-5-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate Openeye Name: [(E)-(3-chloro-5-isopropyl-2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-(3-chloro-2-methyl-4-oxo-5-propan-2-yl-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(3-chloro-2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-(3-chloro-5-isopropyl-4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O5/c1-9(2)13-8-14(10(3)15(18)16(13)21)19-25-17(22)11-4-6-12(7-5-11)20(23)24/h4-9H,1-3H3/b19-14+