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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCOC2=C(C1=O)C=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCN1CCOC2=C(C1=O)C=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

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