furan-2-ylmethyl-[(2S)-3-(5-methyl-2-propan-2-yl-phenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: furan-2-ylmethyl-[(2S)-3-(5-methyl-2-propan-2-yl-phenoxy)-2-oxidanyl-propyl]azanium Openeye Name: 2-furylmethyl-[(2S)-2-hydroxy-3-(2-isopropyl-5-methyl-phenoxy)propyl]ammonium CAS Name: 2-furanylmethyl-[(2S)-2-hydroxy-3-(5-methyl-2-propan-2-ylphenoxy)propyl]ammonium IUPAC Name: furan-2-ylmethyl-[(2S)-2-hydroxy-3-(5-methyl-2-propan-2-ylphenoxy)propyl]azanium Traditional Name: 2-furfuryl-[(2S)-2-hydroxy-3-(2-isopropyl-5-methyl-phenoxy)propyl]ammonium Formula: C18H26NO3+ MolecularWeight: 304.40394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(C[NH2+]CC2=CC=CO2)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC[C@H](C[NH2+]CC2=CC=CO2)O

InChI

InChI=1S/C18H25NO3/c1-13(2)17-7-6-14(3)9-18(17)22-12-15(20)10-19-11-16-5-4-8-21-16/h4-9,13,15,19-20H,10-12H2,1-3H3/p+1/t15-/m0/s1