N-[2-(diethylamino)-3-phenyl-propyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-[2-(diethylamino)-3-phenyl-propyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-[2-(diethylamino)-3-phenyl-propyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[2-(diethylamino)-3-phenylpropyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-[2-(diethylamino)-3-phenylpropyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: N-[2-(diethylamino)-3-phenyl-propyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C21H27N3O4S/c1-3-24(4-2)17(12-16-8-6-5-7-9-16)14-22-29(26,27)18-10-11-20-19(13-18)23-21(25)15-28-20/h5-11,13,17,22H,3-4,12,14-15H2,1-2H3,(H,23,25)