3-nitro-4-[3-oxidanylidene-3-[6-(phenylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide

Systemtic Name: 3-nitro-4-[3-oxidanylidene-3-[6-(phenylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide Openeye Name: 4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]-3-nitro-benzamidine CAS Name: 4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]-3-nitrobenzenecarboximidamide IUPAC Name: 4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]-3-nitrobenzenecarboximidamide Traditional Name: 4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-keto-propyl]-3-nitro-benzamidine Formula: C25H25N5O5S MolecularWeight: 507.5615

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=C(C=C(C=C4)C(=N)N)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=C(C=C(C=C4)C(=N)N)[N+](=O)[O-]

InChI

InChI=1S/C25H25N5O5S/c26-25(27)19-9-8-17(23(16-19)30(32)33)10-13-24(31)29-14-4-5-18-15-20(11-12-22(18)29)28-36(34,35)21-6-2-1-3-7-21/h1-3,6-9,11-12,15-16,28H,4-5,10,13-14H2,(H3,26,27)