2-[(5-methoxy-3-naphthalen-1-ylsulfonyl-2H-indazol-7-yl)oxy]-N-methyl-ethanamine

Systemtic Name: 2-[(5-methoxy-3-naphthalen-1-ylsulfonyl-2H-indazol-7-yl)oxy]-N-methyl-ethanamine Openeye Name: 2-[[5-methoxy-3-(1-naphthylsulfonyl)-2H-indazol-7-yl]oxy]-N-methyl-ethanamine CAS Name: 2-[[5-methoxy-3-(1-naphthalenylsulfonyl)-2H-indazol-7-yl]oxy]-N-methylethanamine IUPAC Name: 2-[(5-methoxy-3-naphthalen-1-ylsulfonyl-2H-indazol-7-yl)oxy]-N-methylethanamine Traditional Name: 2-[[5-methoxy-3-(1-naphthylsulfonyl)-2H-indazol-7-yl]oxy]ethyl-methyl-amine Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CNCCOC1=CC(=CC2=C(NN=C12)S(=O)(=O)C3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

CNCCOC1=CC(=CC2=C(NN=C12)S(=O)(=O)C3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C21H21N3O4S/c1-22-10-11-28-18-13-15(27-2)12-17-20(18)23-24-21(17)29(25,26)19-9-5-7-14-6-3-4-8-16(14)19/h3-9,12-13,22H,10-11H2,1-2H3,(H,23,24)