(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C26H29NO7S MolecularWeight: 499.57596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4C)C)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4C)C)OC

InChI

InChI=1S/C26H29NO7S/c1-16-8-10-21-20(14-24(28)34-25(21)18(16)3)15-33-26(29)19-9-11-22(32-4)23(13-19)35(30,31)27-12-6-5-7-17(27)2/h8-11,13-14,17H,5-7,12,15H2,1-4H3