2-chloranyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzamide Openeye Name: 2-chloro-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzamide CAS Name: 2-chloro-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-5-nitrobenzamide IUPAC Name: 2-chloro-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitrobenzamide Traditional Name: 2-chloro-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzamide Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)CC2OC(=C1)O

InChI

InChI=1S/C17H15ClN2O5/c1-9-6-16(21)25-15-7-10(2-4-12(9)15)19-17(22)13-8-11(20(23)24)3-5-14(13)18/h3,5-6,8,15,21H,2,4,7H2,1H3