N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-morpholin-4-yl-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-morpholin-4-yl-ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(1-methylindolin-5-yl)-2-morpholino-ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-(4-morpholinyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-methyl-2,3-dihydroindol-5-yl)-2-morpholin-4-ylethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(1-methylindolin-5-yl)-2-morpholino-ethyl]-3-nitro-benzenesulfonamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)C(CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)C(CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C21H26N4O5S/c1-23-8-7-17-13-16(5-6-20(17)23)21(24-9-11-30-12-10-24)15-22-31(28,29)19-4-2-3-18(14-19)25(26)27/h2-6,13-14,21-22H,7-12,15H2,1H3