(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 1-indan-5-ylsulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinecarboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxylate Traditional Name: 1-indan-5-ylsulfonylisonipecotic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C27H29NO6S MolecularWeight: 495.58726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4)C

InChI

InChI=1S/C27H29NO6S/c1-17-12-24-22(15-26(29)34-25(24)13-18(17)2)16-33-27(30)20-8-10-28(11-9-20)35(31,32)23-7-6-19-4-3-5-21(19)14-23/h6-7,12-15,20H,3-5,8-11,16H2,1-2H3