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N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitro-benzamide

N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitro-benzamide

Systemtic Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitro-benzamide
Openeye Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitro-benzamide
CAS Name:N-[3-(1-azepanylsulfonyl)phenyl]-4-methoxy-3-nitrobenzamide
IUPAC Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitrobenzamide
Traditional Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-nitro-benzamide
Formula: C20H23N3O6S
MolecularWeight: 433.47812
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]


Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)[N+](=O)[O-]


InChI

InChI=1S/C20H23N3O6S/c1-29-19-10-9-15(13-18(19)23(25)26)20(24)21-16-7-6-8-17(14-16)30(27,28)22-11-4-2-3-5-12-22/h6-10,13-14H,2-5,11-12H2,1H3,(H,21,24)


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