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

Systemtic Name: 3-(azepan-1-yl)-1,4-bis(oxidanylidene)-N-(4-phenoxyphenyl)naphthalene-2-sulfonamide Openeye Name: 3-(azepan-1-yl)-1,4-dioxo-N-(4-phenoxyphenyl)naphthalene-2-sulfonamide CAS Name: 3-(1-azepanyl)-1,4-dioxo-N-(4-phenoxyphenyl)-2-naphthalenesulfonamide IUPAC Name: 3-(azepan-1-yl)-1,4-dioxo-N-(4-phenoxyphenyl)naphthalene-2-sulfonamide Traditional Name: 3-(azepan-1-yl)-1,4-diketo-N-(4-phenoxyphenyl)naphthalene-2-sulfonamide Formula: C28H26N2O5S MolecularWeight: 502.58144

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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=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O5S/c31-26-23-12-6-7-13-24(23)27(32)28(25(26)30-18-8-1-2-9-19-30)36(33,34)29-20-14-16-22(17-15-20)35-21-10-4-3-5-11-21/h3-7,10-17,29H,1-2,8-9,18-19H2