[(2R)-2-butanoyloxy-3-phenylmethoxy-propyl]-diethyl-azanium

Systemtic Name: [(2R)-2-butanoyloxy-3-phenylmethoxy-propyl]-diethyl-azanium Openeye Name: [(2R)-3-benzyloxy-2-butanoyloxy-propyl]-diethyl-ammonium CAS Name: diethyl-[(2R)-2-(1-oxobutoxy)-3-phenylmethoxypropyl]ammonium IUPAC Name: [(2R)-2-butanoyloxy-3-phenylmethoxypropyl]-diethylazanium Traditional Name: [(2R)-3-benzoxy-2-butyryloxy-propyl]-diethyl-ammonium Formula: C18H30NO3+ MolecularWeight: 308.4357

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C[NH+](CC)CC)COCC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)O[C@H](C[NH+](CC)CC)COCC1=CC=CC=C1

InChI

InChI=1S/C18H29NO3/c1-4-10-18(20)22-17(13-19(5-2)6-3)15-21-14-16-11-8-7-9-12-16/h7-9,11-12,17H,4-6,10,13-15H2,1-3H3/p+1/t17-/m1/s1