cyclohexylsulfamic acid; methyl 2-[1-(phenylmethyl)pyrrolidin-3-yl]ethanoate

Systemtic Name: cyclohexylsulfamic acid; methyl 2-[1-(phenylmethyl)pyrrolidin-3-yl]ethanoate Openeye Name: cyclohexylsulfamic acid; methyl 2-(1-benzylpyrrolidin-3-yl)acetate CAS Name: cyclohexylsulfamic acid; 2-[1-(phenylmethyl)-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: cyclohexylsulfamic acid; methyl 2-(1-benzylpyrrolidin-3-yl)acetate Traditional Name: 2-(1-benzylpyrrolidin-3-yl)acetic acid methyl ester; cyclohexylsulfamic acid Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(C1)CC2=CC=CC=C2.C1CCC(CC1)NS(=O)(=O)O

Isomeric SMILES

COC(=O)CC1CCN(C1)CC2=CC=CC=C2.C1CCC(CC1)NS(=O)(=O)O

InChI

InChI=1S/C14H19NO2.C6H13NO3S/c1-17-14(16)9-13-7-8-15(11-13)10-12-5-3-2-4-6-12;8-11(9,10)7-6-4-2-1-3-5-6/h2-6,13H,7-11H2,1H3;6-7H,1-5H2,(H,8,9,10)