4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(3-piperidin-1-ylpropyl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[3-(1-piperidyl)propyl]butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[3-(1-piperidinyl)propyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(3-piperidin-1-ylpropyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(3-piperidinopropyl)butyramide Formula: C20H32ClN3O4S MolecularWeight: 446.00378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCCC(=O)NCCCN2CCCCC2)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCCC(=O)NCCCN2CCCCC2)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H32ClN3O4S/c1-28-19-10-9-17(16-18(19)21)24(29(2,26)27)15-6-8-20(25)22-11-7-14-23-12-4-3-5-13-23/h9-10,16H,3-8,11-15H2,1-2H3,(H,22,25)