N-methyl-3-oxidanylidene-N-[(4-piperidin-1-ylphenyl)methyl]-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-methyl-3-oxidanylidene-N-[(4-piperidin-1-ylphenyl)methyl]-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-methyl-3-oxo-N-[[4-(1-piperidyl)phenyl]methyl]-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-methyl-3-oxo-N-[[4-(1-piperidinyl)phenyl]methyl]-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-methyl-3-oxo-N-[(4-piperidin-1-ylphenyl)methyl]-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-methyl-N-(4-piperidinobenzyl)-4H-1,4-benzoxazine-6-sulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H25N3O4S/c1-23(14-16-5-7-17(8-6-16)24-11-3-2-4-12-24)29(26,27)18-9-10-20-19(13-18)22-21(25)15-28-20/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,22,25)