N-heptan-2-yl-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-heptan-2-yl-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(1-methylhexyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-heptan-2-yl-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-heptan-2-yl-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(1-methylhexyl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C21H34N2O3S MolecularWeight: 394.57126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCCCCC(C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C21H34N2O3S/c1-3-4-6-9-18(2)22-21(24)15-12-19-10-13-20(14-11-19)27(25,26)23-16-7-5-8-17-23/h10-11,13-14,18H,3-9,12,15-17H2,1-2H3,(H,22,24)