4-chloranyl-N-[(Z)-2-methyl-3-phenyl-prop-2-enyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(Z)-2-methyl-3-phenyl-prop-2-enyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[(Z)-2-methyl-3-phenyl-allyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[(Z)-2-methyl-3-phenylprop-2-enyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[(Z)-2-methyl-3-phenylprop-2-enyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-[(Z)-2-methyl-3-phenyl-allyl]benzenesulfonamide Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C/C(=C/C1=CC=CC=C1)/CN(C2CCCCNC2=O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O3S/c1-17(15-18-7-3-2-4-8-18)16-25(21-9-5-6-14-24-22(21)26)29(27,28)20-12-10-19(23)11-13-20/h2-4,7-8,10-13,15,21H,5-6,9,14,16H2,1H3,(H,24,26)/b17-15-