4-chloranyl-N-[4-(ethylamino)-2-oxidanylidene-chromen-3-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-(ethylamino)-2-oxidanylidene-chromen-3-yl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[4-(ethylamino)-2-oxo-chromen-3-yl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[4-(ethylamino)-2-oxo-1-benzopyran-3-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[4-(ethylamino)-2-oxochromen-3-yl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[4-(ethylamino)-2-keto-chromen-3-yl]-3-nitro-benzenesulfonamide Formula: C17H14ClN3O6S MolecularWeight: 423.82756

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=O)OC2=CC=CC=C21)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C(=O)OC2=CC=CC=C21)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O6S/c1-2-19-15-11-5-3-4-6-14(11)27-17(22)16(15)20-28(25,26)10-7-8-12(18)13(9-10)21(23)24/h3-9,19-20H,2H2,1H3