3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-7-yl)azaniumyl]propanimidate

Systemtic Name: 3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-7-yl)azaniumyl]propanimidate Openeye Name: 3-[dimethyl-[1-(1-naphthylsulfonyl)indazol-7-yl]ammonio]propanimidate CAS Name: 3-[dimethyl-[1-(1-naphthalenylsulfonyl)-7-indazolyl]ammonio]propanimidate IUPAC Name: 3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-7-yl)azaniumyl]propanimidate Traditional Name: 3-[dimethyl-[1-(1-naphthylsulfonyl)indazol-7-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=C1N(N=C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[N+](C)(CCC(=N)[O-])C1=CC=CC2=C1N(N=C2)S(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

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