methyl 4-[4-[(2-azanyl-4-methylsulfonyl-phenyl)amino]piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[4-[(2-azanyl-4-methylsulfonyl-phenyl)amino]piperidin-1-yl]piperidine-1-carboxylate Openeye Name: methyl 4-[4-(2-amino-4-methylsulfonyl-anilino)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-(2-amino-4-methylsulfonylanilino)-1-piperidinyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(2-amino-4-methylsulfonylanilino)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-amino-4-mesyl-anilino)piperidino]piperidine-1-carboxylic acid methyl ester Formula: C19H30N4O4S MolecularWeight: 410.5309

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)N2CCC(CC2)NC3=C(C=C(C=C3)S(=O)(=O)C)N

Isomeric SMILES

COC(=O)N1CCC(CC1)N2CCC(CC2)NC3=C(C=C(C=C3)S(=O)(=O)C)N

InChI

InChI=1S/C19H30N4O4S/c1-27-19(24)23-11-7-15(8-12-23)22-9-5-14(6-10-22)21-18-4-3-16(13-17(18)20)28(2,25)26/h3-4,13-15,21H,5-12,20H2,1-2H3