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

Systemtic Name: [(3R,4S)-3-[butyl(methyl)amino]-3,4-dihydro-2H-chromen-4-yl]azanium Openeye Name: [(3R,4S)-3-[butyl(methyl)amino]chroman-4-yl]ammonium CAS Name: [(3R,4S)-3-[butyl(methyl)amino]-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3R,4S)-3-[butyl(methyl)amino]-3,4-dihydro-2H-chromen-4-yl]azanium Traditional Name: [(3R,4S)-3-[butyl(methyl)amino]chroman-4-yl]ammonium Formula: C14H23N2O+ MolecularWeight: 235.34522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1COC2=CC=CC=C2C1[NH3+]

Isomeric SMILES

CCCCN(C)[C@H]1COC2=CC=CC=C2[C@@H]1[NH3+]

InChI

InChI=1S/C14H22N2O/c1-3-4-9-16(2)12-10-17-13-8-6-5-7-11(13)14(12)15/h5-8,12,14H,3-4,9-10,15H2,1-2H3/p+1/t12-,14-/m0/s1