[3-(3H-1,3-benzothiazol-2-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [3-(3H-1,3-benzothiazol-2-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]methyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [3-(3H-1,3-benzothiazol-2-ylidene)-6-oxo-cyclohexa-1,4-dien-1-yl]methyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [3-(3H-1,3-benzothiazol-2-ylidene)-6-oxo-1-cyclohexa-1,4-dienyl]methyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [3-(3H-1,3-benzothiazol-2-ylidene)-6-oxocyclohexa-1,4-dien-1-yl]methyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [3-(3H-1,3-benzothiazol-2-ylidene)-6-keto-cyclohexa-1,4-dien-1-yl]methyl-p-anisyl-ammonium Formula: C22H21N2O2S+ MolecularWeight: 377.47934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]CC2=CC(=C3NC4=CC=CC=C4S3)C=CC2=O

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+]CC2=CC(=C3NC4=CC=CC=C4S3)C=CC2=O

InChI

InChI=1S/C22H20N2O2S/c1-26-18-9-6-15(7-10-18)13-23-14-17-12-16(8-11-20(17)25)22-24-19-4-2-3-5-21(19)27-22/h2-12,23-24H,13-14H2,1H3/p+1