4-[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-2-ethyl-morpholine

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-2-ethyl-morpholine Openeye Name: 4-[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-2-ethyl-morpholine CAS Name: 4-[4-(1-azepanylsulfonyl)-2-nitrophenyl]-2-ethylmorpholine IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)-2-nitrophenyl]-2-ethylmorpholine Traditional Name: 4-[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]-2-ethyl-morpholine Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC1CN(CCO1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O5S/c1-2-15-14-19(11-12-26-15)17-8-7-16(13-18(17)21(22)23)27(24,25)20-9-5-3-4-6-10-20/h7-8,13,15H,2-6,9-12,14H2,1H3