3-(azepan-1-yl)-1,4-bis(oxidanylidene)-N-phenyl-naphthalene-2-sulfonamide

Systemtic Name: 3-(azepan-1-yl)-1,4-bis(oxidanylidene)-N-phenyl-naphthalene-2-sulfonamide Openeye Name: 3-(azepan-1-yl)-1,4-dioxo-N-phenyl-naphthalene-2-sulfonamide CAS Name: 3-(1-azepanyl)-1,4-dioxo-N-phenyl-2-naphthalenesulfonamide IUPAC Name: 3-(azepan-1-yl)-1,4-dioxo-N-phenylnaphthalene-2-sulfonamide Traditional Name: 3-(azepan-1-yl)-1,4-diketo-N-phenyl-naphthalene-2-sulfonamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4S/c25-20-17-12-6-7-13-18(17)21(26)22(19(20)24-14-8-1-2-9-15-24)29(27,28)23-16-10-4-3-5-11-16/h3-7,10-13,23H,1-2,8-9,14-15H2