N-[2-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(2-keto-7-methyl-1H-quinolin-3-yl)ethyl]-4-nitro-benzenesulfonamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5S/c1-12-2-3-13-11-14(18(22)20-17(13)10-12)8-9-19-27(25,26)16-6-4-15(5-7-16)21(23)24/h2-7,10-11,19H,8-9H2,1H3,(H,20,22)