N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-cyclopentyl-propanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-cyclopentyl-propanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-cyclopentyl-propanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-3-cyclopentylpropanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3-cyclopentylpropanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-cyclopentyl-propionamide Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CCC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CCC3CCCC3

InChI

InChI=1S/C21H32N2O4S/c1-27-20-12-11-18(28(25,26)23-14-6-2-3-7-15-23)16-19(20)22-21(24)13-10-17-8-4-5-9-17/h11-12,16-17H,2-10,13-15H2,1H3,(H,22,24)