2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonyl-azepane

Systemtic Name: 2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonyl-azepane Openeye Name: 2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonyl-azepane CAS Name: 2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonylazepane IUPAC Name: 2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonylazepane Traditional Name: 2-(4-methoxyphenyl)-1-(2-nitrophenyl)sulfonyl-azepane Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O5S/c1-26-16-12-10-15(11-13-16)17-7-3-2-6-14-20(17)27(24,25)19-9-5-4-8-18(19)21(22)23/h4-5,8-13,17H,2-3,6-7,14H2,1H3