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

Systemtic Name: 3-(azepan-1-yl)-1,4-bis(oxidanylidene)-N-prop-2-enyl-naphthalene-2-sulfonamide Openeye Name: N-allyl-3-(azepan-1-yl)-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: 3-(1-azepanyl)-1,4-dioxo-N-prop-2-enyl-2-naphthalenesulfonamide IUPAC Name: 3-(azepan-1-yl)-1,4-dioxo-N-prop-2-enylnaphthalene-2-sulfonamide Traditional Name: N-allyl-3-(azepan-1-yl)-1,4-diketo-naphthalene-2-sulfonamide Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)N3CCCCCC3

Isomeric SMILES

C=CCNS(=O)(=O)C1=C(C(=O)C2=CC=CC=C2C1=O)N3CCCCCC3

InChI

InChI=1S/C19H22N2O4S/c1-2-11-20-26(24,25)19-16(21-12-7-3-4-8-13-21)17(22)14-9-5-6-10-15(14)18(19)23/h2,5-6,9-10,20H,1,3-4,7-8,11-13H2