4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-cyclooctyl-butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-cyclooctyl-butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-cyclooctyl-butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-cyclooctylbutanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-cyclooctylbutanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-cyclooctyl-butyramide Formula: C20H31ClN2O4S MolecularWeight: 430.98914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCCC(=O)NC2CCCCCCC2)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)NC2CCCCCCC2)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H31ClN2O4S/c1-27-19-13-12-17(15-18(19)21)23(28(2,25)26)14-8-11-20(24)22-16-9-6-4-3-5-7-10-16/h12-13,15-16H,3-11,14H2,1-2H3,(H,22,24)