(3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)OC)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)[C@H]3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)OC)CC2OC(=C1)O

InChI

InChI=1S/C23H28N2O6S/c1-15-12-22(26)31-21-13-17(5-10-20(15)21)24-23(27)16-4-3-11-25(14-16)32(28,29)19-8-6-18(30-2)7-9-19/h6-9,12,16,21,26H,3-5,10-11,13-14H2,1-2H3/t16-,21?/m0/s1