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

Systemtic Name: 3-(azepan-1-yl)-N,N-bis(2-hydroxyethyl)-1,4-bis(oxidanylidene)naphthalene-2-sulfonamide Openeye Name: 3-(azepan-1-yl)-N,N-bis(2-hydroxyethyl)-1,4-dioxo-naphthalene-2-sulfonamide CAS Name: 3-(1-azepanyl)-N,N-bis(2-hydroxyethyl)-1,4-dioxo-2-naphthalenesulfonamide IUPAC Name: 3-(azepan-1-yl)-N,N-bis(2-hydroxyethyl)-1,4-dioxonaphthalene-2-sulfonamide Traditional Name: 3-(azepan-1-yl)-N,N-bis(2-hydroxyethyl)-1,4-diketo-naphthalene-2-sulfonamide Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N(CCO)CCO

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N(CCO)CCO

InChI

InChI=1S/C20H26N2O6S/c23-13-11-22(12-14-24)29(27,28)20-17(21-9-5-1-2-6-10-21)18(25)15-7-3-4-8-16(15)19(20)26/h3-4,7-8,23-24H,1-2,5-6,9-14H2