cyclopropylmethyl-[(2R)-3-(4-methoxycarbonylphenoxy)-2-oxidanyl-propyl]-propyl-azanium

Systemtic Name: cyclopropylmethyl-[(2R)-3-(4-methoxycarbonylphenoxy)-2-oxidanyl-propyl]-propyl-azanium Openeye Name: cyclopropylmethyl-[(2R)-2-hydroxy-3-(4-methoxycarbonylphenoxy)propyl]-propyl-ammonium CAS Name: cyclopropylmethyl-[(2R)-2-hydroxy-3-(4-methoxycarbonylphenoxy)propyl]-propylammonium IUPAC Name: cyclopropylmethyl-[(2R)-2-hydroxy-3-(4-methoxycarbonylphenoxy)propyl]-propylazanium Traditional Name: [(2R)-3-(4-carbomethoxyphenoxy)-2-hydroxy-propyl]-(cyclopropylmethyl)-propyl-ammonium Formula: C18H28NO4+ MolecularWeight: 322.41922

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1CC1)CC(COC2=CC=C(C=C2)C(=O)OC)O

Isomeric SMILES

CCC[NH+](CC1CC1)C[C@H](COC2=CC=C(C=C2)C(=O)OC)O

InChI

InChI=1S/C18H27NO4/c1-3-10-19(11-14-4-5-14)12-16(20)13-23-17-8-6-15(7-9-17)18(21)22-2/h6-9,14,16,20H,3-5,10-13H2,1-2H3/p+1/t16-/m1/s1