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

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

Systemtic Name:N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)propanamide
Openeye Name:N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)propanamide
CAS Name:N-[4-(1-azepanylsulfonyl)phenyl]-2-(2-nitrophenoxy)propanamide
IUPAC Name:N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)propanamide
Traditional Name:N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-nitrophenoxy)propionamide
Formula: C21H25N3O6S
MolecularWeight: 447.5047
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)OC3=CC=CC=C3[N+](=O)[O-]


Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)OC3=CC=CC=C3[N+](=O)[O-]


InChI

InChI=1S/C21H25N3O6S/c1-16(30-20-9-5-4-8-19(20)24(26)27)21(25)22-17-10-12-18(13-11-17)31(28,29)23-14-6-2-3-7-15-23/h4-5,8-13,16H,2-3,6-7,14-15H2,1H3,(H,22,25)


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