(phenylmethyl) N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ium-1-yl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ium-1-yl-butan-2-yl]carbamate Openeye Name: benzyl N-methyl-N-[(1S)-2-methyl-1-(pyrrolidin-1-ium-1-ylmethyl)propyl]carbamate CAS Name: N-methyl-N-[(2S)-3-methyl-1-(1-pyrrolidin-1-iumyl)butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ium-1-ylbutan-2-yl]carbamate Traditional Name: N-methyl-N-[(1S)-2-methyl-1-(pyrrolidin-1-ium-1-ylmethyl)propyl]carbamic acid benzyl ester Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C[NH+]1CCCC1)N(C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C[NH+]1CCCC1)N(C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O2/c1-15(2)17(13-20-11-7-8-12-20)19(3)18(21)22-14-16-9-5-4-6-10-16/h4-6,9-10,15,17H,7-8,11-14H2,1-3H3/p+1/t17-/m1/s1