[(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-3,4-dihydrochromen-4-yl]azanium

Systemtic Name: [(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-3,4-dihydrochromen-4-yl]azanium Openeye Name: [(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-chroman-4-yl]ammonium CAS Name: [(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-3,4-dihydrochromen-4-yl]azanium Traditional Name: [(3S,4R)-7-ethoxy-3-(4-methoxyphenyl)-2,2-dimethyl-chroman-4-yl]ammonium Formula: C20H26NO3+ MolecularWeight: 328.42534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(C(C(O2)(C)C)C3=CC=C(C=C3)OC)[NH3+]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[C@@H]([C@@H](C(O2)(C)C)C3=CC=C(C=C3)OC)[NH3+]

InChI

InChI=1S/C20H25NO3/c1-5-23-15-10-11-16-17(12-15)24-20(2,3)18(19(16)21)13-6-8-14(22-4)9-7-13/h6-12,18-19H,5,21H2,1-4H3/p+1/t18-,19-/m0/s1