N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c24-20(15-29-19-8-4-3-7-18(19)23(25)26)21-16-9-11-17(12-10-16)30(27,28)22-13-5-1-2-6-14-22/h3-4,7-12H,1-2,5-6,13-15H2,(H,21,24)