[(3R,4S)-3-(2-methoxy-4-methyl-phenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium

Systemtic Name: [(3R,4S)-3-(2-methoxy-4-methyl-phenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium Openeye Name: [(3R,4S)-3-(2-methoxy-4-methyl-phenoxy)chroman-4-yl]ammonium CAS Name: [(3R,4S)-3-(2-methoxy-4-methylphenoxy)-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3R,4S)-3-(2-methoxy-4-methylphenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium Traditional Name: [(3R,4S)-3-(2-methoxy-4-methyl-phenoxy)chroman-4-yl]ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2COC3=CC=CC=C3C2[NH3+])OC

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@H]2COC3=CC=CC=C3[C@@H]2[NH3+])OC

InChI

InChI=1S/C17H19NO3/c1-11-7-8-14(15(9-11)19-2)21-16-10-20-13-6-4-3-5-12(13)17(16)18/h3-9,16-17H,10,18H2,1-2H3/p+1/t16-,17-/m0/s1