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

Systemtic Name: (phenylmethyl) N-methyl-N-[(2S,3S)-3-methyl-1-pyrrolidin-1-ium-1-yl-pentan-2-yl]carbamate Openeye Name: benzyl N-methyl-N-[(1S,2S)-2-methyl-1-(pyrrolidin-1-ium-1-ylmethyl)butyl]carbamate CAS Name: N-methyl-N-[(2S,3S)-3-methyl-1-(1-pyrrolidin-1-iumyl)pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-methyl-N-[(2S,3S)-3-methyl-1-pyrrolidin-1-ium-1-ylpentan-2-yl]carbamate Traditional Name: N-methyl-N-[(1S,2S)-2-methyl-1-(pyrrolidin-1-ium-1-ylmethyl)butyl]carbamic acid benzyl ester Formula: C19H31N2O2+ MolecularWeight: 319.46164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O2/c1-4-16(2)18(14-21-12-8-9-13-21)20(3)19(22)23-15-17-10-6-5-7-11-17/h5-7,10-11,16,18H,4,8-9,12-15H2,1-3H3/p+1/t16-,18+/m0/s1