1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)isonipecotamide Formula: C22H24ClN3O7S MolecularWeight: 509.95986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)CC2OC(=C1)O

InChI

InChI=1S/C22H24ClN3O7S/c1-13-10-21(27)33-19-11-15(2-4-17(13)19)24-22(28)14-6-8-25(9-7-14)34(31,32)20-12-16(26(29)30)3-5-18(20)23/h3,5,10,12,14,19,27H,2,4,6-9,11H2,1H3