methyl 2-[4-[(1-phenylcyclobutyl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(1-phenylcyclobutyl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[(1-phenylcyclobutyl)methylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-[(1-phenylcyclobutyl)methylamino]methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(1-phenylcyclobutyl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(1-phenylcyclobutyl)methylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3(CCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3(CCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N2O5S/c1-32-24(29)21-10-5-6-11-22(21)33(30,31)27-16-12-19(13-17-27)23(28)26-18-25(14-7-15-25)20-8-3-2-4-9-20/h2-6,8-11,19H,7,12-18H2,1H3,(H,26,28)