2-(4-piperazin-1-ium-1-ylidenecyclohexa-2,5-dien-1-ylidene)chromene-3,4-diol

Systemtic Name: 2-(4-piperazin-1-ium-1-ylidenecyclohexa-2,5-dien-1-ylidene)chromene-3,4-diol Openeye Name: 2-(4-piperazin-1-ium-1-ylidenecyclohexa-2,5-dien-1-ylidene)chromene-3,4-diol CAS Name: 2-[4-(1-piperazin-1-iumylidene)-1-cyclohexa-2,5-dienylidene]-1-benzopyran-3,4-diol IUPAC Name: 2-(4-piperazin-1-ium-1-ylidenecyclohexa-2,5-dien-1-ylidene)chromene-3,4-diol Traditional Name: 2-(4-piperazin-1-ium-1-ylidenecyclohexa-2,5-dien-1-ylidene)chromene-3,4-diol Formula: C19H19N2O3+ MolecularWeight: 323.36576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2C=CC(=C3C(=C(C4=CC=CC=C4O3)O)O)C=C2)CCN1

Isomeric SMILES

C1C[N+](=C2C=CC(=C3C(=C(C4=CC=CC=C4O3)O)O)C=C2)CCN1

InChI

InChI=1S/C19H18N2O3/c22-17-15-3-1-2-4-16(15)24-19(18(17)23)13-5-7-14(8-6-13)21-11-9-20-10-12-21/h1-8,20,23H,9-12H2/p+1