4-(azepan-1-ylcarbonylamino)-2-chloranyl-benzenesulfonyl chloride

Systemtic Name: 4-(azepan-1-ylcarbonylamino)-2-chloranyl-benzenesulfonyl chloride Openeye Name: 4-(azepane-1-carbonylamino)-2-chloro-benzenesulfonyl chloride CAS Name: 4-[[1-azepanyl(oxo)methyl]amino]-2-chlorobenzenesulfonyl chloride IUPAC Name: 4-(azepane-1-carbonylamino)-2-chlorobenzenesulfonyl chloride Traditional Name: 4-(azepane-1-carbonylamino)-2-chloro-benzenesulfonyl chloride Formula: C13H16Cl2N2O3S MolecularWeight: 351.24874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)Cl)Cl

InChI

InChI=1S/C13H16Cl2N2O3S/c14-11-9-10(5-6-12(11)21(15,19)20)16-13(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2,(H,16,18)