4-(azepan-1-ylsulfonyl)-N-cyclohexyl-N-methyl-2-nitro-aniline

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-cyclohexyl-N-methyl-2-nitro-aniline Openeye Name: 4-(azepan-1-ylsulfonyl)-N-cyclohexyl-N-methyl-2-nitro-aniline CAS Name: 4-(1-azepanylsulfonyl)-N-cyclohexyl-N-methyl-2-nitroaniline IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-cyclohexyl-N-methyl-2-nitroaniline Traditional Name: [4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-cyclohexyl-methyl-amine Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H29N3O4S/c1-20(16-9-5-4-6-10-16)18-12-11-17(15-19(18)22(23)24)27(25,26)21-13-7-2-3-8-14-21/h11-12,15-16H,2-10,13-14H2,1H3