tert-butyl 5-[(E)-5-methoxy-5-oxidanylidene-4-(phenylsulfonyl)pent-2-en-2-yl]-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 5-[(E)-5-methoxy-5-oxidanylidene-4-(phenylsulfonyl)pent-2-en-2-yl]-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 5-[(E)-3-(benzenesulfonyl)-4-methoxy-1-methyl-4-oxo-but-1-enyl]-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[(E)-4-(benzenesulfonyl)-5-methoxy-5-oxopent-2-en-2-yl]-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(E)-4-(benzenesulfonyl)-5-methoxy-5-oxopent-2-en-2-yl]-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(E)-3-besyl-4-keto-4-methoxy-1-methyl-but-1-enyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C22H29NO6S MolecularWeight: 435.53376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(C(=O)OC)S(=O)(=O)C1=CC=CC=C1)C2=CN(CCC2)C(=O)OC(C)(C)C

Isomeric SMILES

C/C(=C\C(C(=O)OC)S(=O)(=O)C1=CC=CC=C1)/C2=CN(CCC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H29NO6S/c1-16(17-10-9-13-23(15-17)21(25)29-22(2,3)4)14-19(20(24)28-5)30(26,27)18-11-7-6-8-12-18/h6-8,11-12,14-15,19H,9-10,13H2,1-5H3/b16-14+