furan-2-ylmethyl-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-oxan-4-yl]ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-oxan-4-yl]ethyl]azanium Openeye Name: 2-furylmethyl-[2-[(2S,4S)-2-isopropyl-4-phenyl-tetrahydropyran-4-yl]ethyl]ammonium CAS Name: 2-furanylmethyl-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-4-oxanyl]ethyl]ammonium IUPAC Name: furan-2-ylmethyl-[2-[(2S,4S)-4-phenyl-2-propan-2-yloxan-4-yl]ethyl]azanium Traditional Name: 2-furfuryl-[2-[(2S,4S)-2-isopropyl-4-phenyl-tetrahydropyran-4-yl]ethyl]ammonium Formula: C21H30NO2+ MolecularWeight: 328.4684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC(CCO1)(CC[NH2+]CC2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H]1C[C@@](CCO1)(CC[NH2+]CC2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C21H29NO2/c1-17(2)20-15-21(11-14-24-20,18-7-4-3-5-8-18)10-12-22-16-19-9-6-13-23-19/h3-9,13,17,20,22H,10-12,14-16H2,1-2H3/p+1/t20-,21-/m0/s1