3-[[(E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoyl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[[(E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoyl]amino]propyl-diethyl-azanium Openeye Name: diethyl-[3-[[(E)-3-(4-indolin-1-ylsulfonylphenyl)prop-2-enoyl]amino]propyl]ammonium CAS Name: 3-[[(E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]propyl-diethylammonium IUPAC Name: 3-[[(E)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]prop-2-enoyl]amino]propyl-diethylazanium Traditional Name: diethyl-[3-[[(E)-3-(4-indolin-1-ylsulfonylphenyl)acryloyl]amino]propyl]ammonium Formula: C24H32N3O3S+ MolecularWeight: 442.59418

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C=CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)/C=C/C1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C24H31N3O3S/c1-3-26(4-2)18-7-17-25-24(28)15-12-20-10-13-22(14-11-20)31(29,30)27-19-16-21-8-5-6-9-23(21)27/h5-6,8-15H,3-4,7,16-19H2,1-2H3,(H,25,28)/p+1/b15-12+