4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynylindol-3-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynylindol-3-yl)ethyl]benzenesulfonamide Openeye Name: 4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynylindol-3-yl)ethyl]benzenesulfonamide CAS Name: 4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynyl-3-indolyl)ethyl]benzenesulfonamide IUPAC Name: 4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynylindol-3-yl)ethyl]benzenesulfonamide Traditional Name: 4-nitro-N-oct-1-ynyl-N-[2-(1-oct-1-ynylindol-3-yl)ethyl]benzenesulfonamide Formula: C32H39N3O4S MolecularWeight: 561.73476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CN1C=C(C2=CC=CC=C21)CCN(C#CCCCCCC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC#CN1C=C(C2=CC=CC=C21)CCN(C#CCCCCCC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C32H39N3O4S/c1-3-5-7-9-11-15-24-33-27-28(31-17-13-14-18-32(31)33)23-26-34(25-16-12-10-8-6-4-2)40(38,39)30-21-19-29(20-22-30)35(36)37/h13-14,17-22,27H,3-12,23,26H2,1-2H3