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

Systemtic Name: 3-(azepan-1-yl)-1,4-bis(oxidanylidene)-N-phenethyl-naphthalene-2-sulfonamide Openeye Name: 3-(azepan-1-yl)-1,4-dioxo-N-phenethyl-naphthalene-2-sulfonamide CAS Name: 3-(1-azepanyl)-1,4-dioxo-N-phenethyl-2-naphthalenesulfonamide IUPAC Name: 3-(azepan-1-yl)-1,4-dioxo-N-phenethylnaphthalene-2-sulfonamide Traditional Name: 3-(azepan-1-yl)-1,4-diketo-N-phenethyl-naphthalene-2-sulfonamide Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4S/c27-22-19-12-6-7-13-20(19)23(28)24(21(22)26-16-8-1-2-9-17-26)31(29,30)25-15-14-18-10-4-3-5-11-18/h3-7,10-13,25H,1-2,8-9,14-17H2