1-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-nitro-indazole

Systemtic Name: 1-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-nitro-indazole Openeye Name: 1-[[4-(2-naphthylsulfonyl)piperazin-1-yl]methyl]-5-nitro-indazole CAS Name: 1-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methyl]-5-nitroindazole IUPAC Name: 1-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-5-nitroindazole Traditional Name: 1-[[4-(2-naphthylsulfonyl)piperazino]methyl]-5-nitro-indazole Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H21N5O4S/c28-27(29)20-6-8-22-19(13-20)15-23-26(22)16-24-9-11-25(12-10-24)32(30,31)21-7-5-17-3-1-2-4-18(17)14-21/h1-8,13-15H,9-12,16H2