[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]ammonium Formula: C16H16NO3+ MolecularWeight: 270.30314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C[NH2+]C=C3C=CC(=O)C=C3

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)C[NH2+]C=C3C=CC(=O)C=C3

InChI

InChI=1S/C16H15NO3/c18-13-7-5-12(6-8-13)9-17-10-14-11-19-15-3-1-2-4-16(15)20-14/h1-9,14,17H,10-11H2/p+1/t14-/m0/s1