N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-pyrrolidin-1-yl-ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-pyrrolidin-1-yl-ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-pyrrolidin-1-yl-acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(1-pyrrolidinyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-pyrrolidin-1-ylacetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-pyrrolidino-acetamide Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3CCCC3

InChI

InChI=1S/C19H29N3O4S/c1-26-18-9-8-16(27(24,25)22-12-4-2-3-5-13-22)14-17(18)20-19(23)15-21-10-6-7-11-21/h8-9,14H,2-7,10-13,15H2,1H3,(H,20,23)