N-[[2,3-bis(chloranyl)phenyl]methyl]-N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[[2,3-bis(chloranyl)phenyl]methyl]-N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: (2,3-dichlorobenzyl)-methyl-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C19H21Cl2N3O4S MolecularWeight: 458.35874

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)Cl)Cl)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C(=CC=C1)Cl)Cl)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21Cl2N3O4S/c1-22(13-14-6-5-7-16(20)19(14)21)17-9-8-15(12-18(17)24(25)26)29(27,28)23-10-3-2-4-11-23/h5-9,12H,2-4,10-11,13H2,1H3