N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)naphthalene-1-sulfonamide

Systemtic Name: N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)naphthalene-1-sulfonamide Openeye Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)naphthalene-1-sulfonamide CAS Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-1-naphthalenesulfonamide IUPAC Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)naphthalene-1-sulfonamide Traditional Name: N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)naphthalene-1-sulfonamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC4=CC=CC=C43)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC4=CC=CC=C43)C(=O)N1

InChI

InChI=1S/C21H20N2O4S/c1-2-15-13-27-19-11-10-16(12-18(19)21(24)22-15)23-28(25,26)20-9-5-7-14-6-3-4-8-17(14)20/h3-12,15,23H,2,13H2,1H3,(H,22,24)