1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium perchlorate

Systemtic Name: 1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium perchlorate Openeye Name: 1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium perchlorate CAS Name: 1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]piperazin-4-ium perchlorate IUPAC Name: 1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium perchlorate Traditional Name: 1-ethyl-4-[6-methoxy-2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium perchlorate Formula: C23H27ClN2O7 MolecularWeight: 478.92268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC=C(C=C4)OC)CC1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC=C(C=C4)OC)CC1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H27N2O3.ClHO4/c1-4-24-11-13-25(14-12-24)21-16-23(17-5-7-18(26-2)8-6-17)28-22-10-9-19(27-3)15-20(21)22;2-1(3,4)5/h5-10,15-16H,4,11-14H2,1-3H3;(H,2,3,4,5)/q+1;/p-1