N-(2-methylphenyl)-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-(2-methylphenyl)-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-(o-tolyl)-4-(1-piperidylsulfonyl)aniline CAS Name: N-(2-methylphenyl)-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-(2-methylphenyl)-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: (2-nitro-4-piperidinosulfonyl-phenyl)-(o-tolyl)amine Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-14-7-3-4-8-16(14)19-17-10-9-15(13-18(17)21(22)23)26(24,25)20-11-5-2-6-12-20/h3-4,7-10,13,19H,2,5-6,11-12H2,1H3