[4-(aminomethyl)-1-(phenylmethyl)pyrrolidin-3-yl] methanesulfonate

Systemtic Name: [4-(aminomethyl)-1-(phenylmethyl)pyrrolidin-3-yl] methanesulfonate Openeye Name: [4-(aminomethyl)-1-benzyl-pyrrolidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [4-(aminomethyl)-1-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: [4-(aminomethyl)-1-benzylpyrrolidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-(aminomethyl)-1-benzyl-pyrrolidin-3-yl] ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CN(CC1CN)CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)OC1CN(CC1CN)CC2=CC=CC=C2

InChI

InChI=1S/C13H20N2O3S/c1-19(16,17)18-13-10-15(9-12(13)7-14)8-11-5-3-2-4-6-11/h2-6,12-13H,7-10,14H2,1H3