N-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide

Systemtic Name: N-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-hydroxypropyl)-4-nitro-benzenesulfonamide CAS Name: N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-hydroxypropyl)-4-nitrobenzenesulfonamide IUPAC Name: N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-hydroxypropyl)-4-nitrobenzenesulfonamide Traditional Name: N-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-N-(3-hydroxypropyl)-4-nitro-benzenesulfonamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6S/c1-2-15-4-9-20-16(12-15)13-17(21(26)22-20)14-23(10-3-11-25)31(29,30)19-7-5-18(6-8-19)24(27)28/h4-9,12-13,25H,2-3,10-11,14H2,1H3,(H,22,26)