1-(6-methoxy-2-phenyl-chromen-4-ylidene)-4-methyl-piperazin-1-ium perchlorate

Systemtic Name: 1-(6-methoxy-2-phenyl-chromen-4-ylidene)-4-methyl-piperazin-1-ium perchlorate Openeye Name: 1-(6-methoxy-2-phenyl-chromen-4-ylidene)-4-methyl-piperazin-1-ium perchlorate CAS Name: 1-(6-methoxy-2-phenyl-1-benzopyran-4-ylidene)-4-methylpiperazin-1-ium perchlorate IUPAC Name: 1-(6-methoxy-2-phenylchromen-4-ylidene)-4-methylpiperazin-1-ium perchlorate Traditional Name: 1-(6-methoxy-2-phenyl-chromen-4-ylidene)-4-methyl-piperazin-1-ium perchlorate Formula: C21H23ClN2O6 MolecularWeight: 434.87012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC=CC=C4)CC1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC=CC=C4)CC1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H23N2O2.ClHO4/c1-22-10-12-23(13-11-22)19-15-21(16-6-4-3-5-7-16)25-20-9-8-17(24-2)14-18(19)20;2-1(3,4)5/h3-9,14-15H,10-13H2,1-2H3;(H,2,3,4,5)/q+1;/p-1