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

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(cyclopropylmethoxy)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(cyclopropylmethoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(cyclopropylmethoxy)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(cyclopropylmethoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(cyclopropylmethoxy)acetamide Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COCC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COCC3CC3

InChI

InChI=1S/C19H28N2O5S/c1-25-18-9-8-16(27(23,24)21-10-4-2-3-5-11-21)12-17(18)20-19(22)14-26-13-15-6-7-15/h8-9,12,15H,2-7,10-11,13-14H2,1H3,(H,20,22)