3-(dimethylamino)propyl-[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]azanium perchlorate

Systemtic Name: 3-(dimethylamino)propyl-[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]azanium perchlorate Openeye Name: 3-(dimethylamino)propyl-[6-methyl-2-(p-tolyl)chromen-4-ylidene]ammonium perchlorate CAS Name: 3-(dimethylamino)propyl-[6-methyl-2-(4-methylphenyl)-1-benzopyran-4-ylidene]ammonium perchlorate IUPAC Name: 3-(dimethylamino)propyl-[6-methyl-2-(4-methylphenyl)chromen-4-ylidene]azanium perchlorate Traditional Name: 3-(dimethylamino)propyl-[6-methyl-2-(p-tolyl)chromen-4-ylidene]ammonium perchlorate Formula: C22H27ClN2O5 MolecularWeight: 434.91318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=[NH+]CCCN(C)C)C3=C(O2)C=CC(=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=[NH+]CCCN(C)C)C3=C(O2)C=CC(=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H26N2O.ClHO4/c1-16-6-9-18(10-7-16)22-15-20(23-12-5-13-24(3)4)19-14-17(2)8-11-21(19)25-22;2-1(3,4)5/h6-11,14-15H,5,12-13H2,1-4H3;(H,2,3,4,5)