1-(5-chloranyl-2-methoxy-phenyl)sulfonyl-4-(furan-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)sulfonyl-4-(furan-2-ylmethyl)-1,4-diazepane Openeye Name: 1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-(2-furylmethyl)-1,4-diazepane CAS Name: 1-(5-chloro-2-methoxyphenyl)sulfonyl-4-(2-furanylmethyl)-1,4-diazepane IUPAC Name: 1-(5-chloro-2-methoxyphenyl)sulfonyl-4-(furan-2-ylmethyl)-1,4-diazepane Traditional Name: 1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-(2-furfuryl)-1,4-diazepane Formula: C17H21ClN2O4S MolecularWeight: 384.87764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCN(CC2)CC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C17H21ClN2O4S/c1-23-16-6-5-14(18)12-17(16)25(21,22)20-8-3-7-19(9-10-20)13-15-4-2-11-24-15/h2,4-6,11-12H,3,7-10,13H2,1H3