N-[2-[2-iodanyl-5-methoxy-4-nitro-1-(phenylsulfonyl)indol-3-yl]ethyl]ethanamide

Systemtic Name: N-[2-[2-iodanyl-5-methoxy-4-nitro-1-(phenylsulfonyl)indol-3-yl]ethyl]ethanamide Openeye Name: N-[2-[1-(benzenesulfonyl)-2-iodo-5-methoxy-4-nitro-indol-3-yl]ethyl]acetamide CAS Name: N-[2-[1-(benzenesulfonyl)-2-iodo-5-methoxy-4-nitro-3-indolyl]ethyl]acetamide IUPAC Name: N-[2-[1-(benzenesulfonyl)-2-iodo-5-methoxy-4-nitroindol-3-yl]ethyl]acetamide Traditional Name: N-[2-(1-besyl-2-iodo-5-methoxy-4-nitro-indol-3-yl)ethyl]acetamide Formula: C19H18IN3O6S MolecularWeight: 543.33219

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=C(N(C2=C1C(=C(C=C2)OC)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)I

Isomeric SMILES

CC(=O)NCCC1=C(N(C2=C1C(=C(C=C2)OC)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)I

InChI

InChI=1S/C19H18IN3O6S/c1-12(24)21-11-10-14-17-15(8-9-16(29-2)18(17)23(25)26)22(19(14)20)30(27,28)13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H,21,24)