[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium

Systemtic Name: [(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Openeye Name: [(3S)-8-methoxychroman-3-yl]-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium CAS Name: [(3S)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl]-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: [(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Traditional Name: [(3S)-8-methoxychroman-3-yl]-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(C2)[NH2+]CC3=CC=CN3C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC2=C1OC[C@H](C2)[NH2+]CC3=CC=CN3C4=CN=CC=C4

InChI

InChI=1S/C20H21N3O2/c1-24-19-8-2-5-15-11-16(14-25-20(15)19)22-13-18-7-4-10-23(18)17-6-3-9-21-12-17/h2-10,12,16,22H,11,13-14H2,1H3/p+1/t16-/m0/s1