3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-4-yl)azaniumyl]propanimidate

Systemtic Name: 3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-4-yl)azaniumyl]propanimidate Openeye Name: 3-[dimethyl-[1-(1-naphthylsulfonyl)indazol-4-yl]ammonio]propanimidate CAS Name: 3-[dimethyl-[1-(1-naphthalenylsulfonyl)-4-indazolyl]ammonio]propanimidate IUPAC Name: 3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-4-yl)azaniumyl]propanimidate Traditional Name: 3-[dimethyl-[1-(1-naphthylsulfonyl)indazol-4-yl]ammonio]propionimidate Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC(=N)[O-])C1=CC=CC2=C1C=NN2S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[N+](C)(CCC(=N)[O-])C1=CC=CC2=C1C=NN2S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O3S/c1-26(2,14-13-22(23)27)20-11-6-10-19-18(20)15-24-25(19)30(28,29)21-12-5-8-16-7-3-4-9-17(16)21/h3-12,15H,13-14H2,1-2H3,(H-,23,27)