[(2R)-2-oxidanyl-3-(4-propanoylphenoxy)propyl]-dipropyl-azanium

Systemtic Name: [(2R)-2-oxidanyl-3-(4-propanoylphenoxy)propyl]-dipropyl-azanium Openeye Name: [(2R)-2-hydroxy-3-(4-propanoylphenoxy)propyl]-dipropyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]-dipropylammonium IUPAC Name: [(2R)-2-hydroxy-3-(4-propanoylphenoxy)propyl]-dipropylazanium Traditional Name: [(2R)-2-hydroxy-3-(4-propionylphenoxy)propyl]-dipropyl-ammonium Formula: C18H30NO3+ MolecularWeight: 308.4357

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC(COC1=CC=C(C=C1)C(=O)CC)O

Isomeric SMILES

CCC[NH+](CCC)C[C@H](COC1=CC=C(C=C1)C(=O)CC)O

InChI

InChI=1S/C18H29NO3/c1-4-11-19(12-5-2)13-16(20)14-22-17-9-7-15(8-10-17)18(21)6-3/h7-10,16,20H,4-6,11-14H2,1-3H3/p+1/t16-/m1/s1