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3-[4-(azepan-1-ylsulfonyl)phenyl]-N-heptan-2-yl-propanamide

3-[4-(azepan-1-ylsulfonyl)phenyl]-N-heptan-2-yl-propanamide

Systemtic Name:3-[4-(azepan-1-ylsulfonyl)phenyl]-N-heptan-2-yl-propanamide
Openeye Name:3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-methylhexyl)propanamide
CAS Name:3-[4-(1-azepanylsulfonyl)phenyl]-N-heptan-2-ylpropanamide
IUPAC Name:3-[4-(azepan-1-ylsulfonyl)phenyl]-N-heptan-2-ylpropanamide
Traditional Name:3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(1-methylhexyl)propionamide
Formula: C22H36N2O3S
MolecularWeight: 408.59784
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2


Isomeric SMILES

CCCCCC(C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2


InChI

InChI=1S/C22H36N2O3S/c1-3-4-7-10-19(2)23-22(25)16-13-20-11-14-21(15-12-20)28(26,27)24-17-8-5-6-9-18-24/h11-12,14-15,19H,3-10,13,16-18H2,1-2H3,(H,23,25)


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