N-(5-chloranyl-2-methoxy-phenyl)-4-[methylsulfonyl(phenyl)amino]butanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-[methylsulfonyl(phenyl)amino]butanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(N-methylsulfonylanilino)butanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(N-methylsulfonylanilino)butanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(N-methylsulfonylanilino)butanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(N-mesylanilino)butyramide Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H21ClN2O4S/c1-25-17-11-10-14(19)13-16(17)20-18(22)9-6-12-21(26(2,23)24)15-7-4-3-5-8-15/h3-5,7-8,10-11,13H,6,9,12H2,1-2H3,(H,20,22)