[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [5-[(1R,2S)-2-methylcyclopropyl]-2-furyl]methyl-(p-tolylmethyl)ammonium CAS Name: [5-[(1R,2S)-2-methylcyclopropyl]-2-furanyl]methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (4-methylbenzyl)-[[5-[(1R,2S)-2-methylcyclopropyl]-2-furyl]methyl]ammonium Formula: C17H22NO+ MolecularWeight: 256.36268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)C[NH2+]CC3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1C[C@H]1C2=CC=C(O2)C[NH2+]CC3=CC=C(C=C3)C

InChI

InChI=1S/C17H21NO/c1-12-3-5-14(6-4-12)10-18-11-15-7-8-17(19-15)16-9-13(16)2/h3-8,13,16,18H,9-11H2,1-2H3/p+1/t13-,16+/m0/s1