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

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-butan-2-yl-propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-sec-butyl-propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-butan-2-ylpropanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-butan-2-ylpropanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-sec-butyl-propionamide Formula: C19H30N2O3S MolecularWeight: 366.5181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O3S/c1-3-16(2)20-19(22)13-10-17-8-11-18(12-9-17)25(23,24)21-14-6-4-5-7-15-21/h8-9,11-12,16H,3-7,10,13-15H2,1-2H3,(H,20,22)