[(Z)-[2-[(1-methylnaphthalen-2-yl)methyl]isoquinolin-3-ylidene]methyl]-oxidanylidene-azanium bromide

Systemtic Name: [(Z)-[2-[(1-methylnaphthalen-2-yl)methyl]isoquinolin-3-ylidene]methyl]-oxidanylidene-azanium bromide Openeye Name: [(Z)-[2-[(1-methyl-2-naphthyl)methyl]-3-isoquinolylidene]methyl]-oxo-ammonium bromide CAS Name: [(Z)-[2-[(1-methyl-2-naphthalenyl)methyl]-3-isoquinolinylidene]methyl]-oxoammonium bromide IUPAC Name: [(Z)-[2-[(1-methylnaphthalen-2-yl)methyl]isoquinolin-3-ylidene]methyl]-oxoazanium bromide Traditional Name: keto-[(Z)-[2-[(1-methyl-2-naphthyl)methyl]-3-isoquinolylidene]methyl]ammonium bromide Formula: C22H19BrN2O MolecularWeight: 407.30306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=CC=CC=C12)CN3C=C4C=CC=CC4=CC3=C[NH+]=O.[Br-]

Isomeric SMILES

CC1=C(C=CC2=CC=CC=C12)CN\3C=C4C=CC=CC4=C/C3=C/[NH+]=O.[Br-]

InChI

InChI=1S/C22H18N2O.BrH/c1-16-19(11-10-17-6-4-5-9-22(16)17)14-24-15-20-8-3-2-7-18(20)12-21(24)13-23-25;/h2-13,15H,14H2,1H3;1H/b21-13-;