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

Systemtic Name: N-[(Z)-2-bromanyl-3-phenyl-prop-2-enyl]-4-chloranyl-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: N-[(Z)-2-bromo-3-phenyl-allyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[(Z)-2-bromo-3-phenylprop-2-enyl]-4-chloro-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[(Z)-2-bromo-3-phenylprop-2-enyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-[(Z)-2-bromo-3-phenyl-allyl]-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C21H22BrClN2O3S MolecularWeight: 497.83298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC(=CC2=CC=CC=C2)Br)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(C/C(=C/C2=CC=CC=C2)/Br)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22BrClN2O3S/c22-17(14-16-6-2-1-3-7-16)15-25(20-8-4-5-13-24-21(20)26)29(27,28)19-11-9-18(23)10-12-19/h1-3,6-7,9-12,14,20H,4-5,8,13,15H2,(H,24,26)/b17-14-