3-[2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]azaniumylpropyl-dimethyl-azanium

Systemtic Name: 3-[2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]azaniumylpropyl-dimethyl-azanium Openeye Name: 3-[2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]ammoniopropyl-dimethyl-ammonium CAS Name: 3-[[2-(4-chlorophenyl)-6-methyl-1-benzopyran-4-ylidene]ammonio]propyl-dimethylammonium IUPAC Name: 3-[2-(4-chlorophenyl)-6-methylchromen-4-ylidene]azaniumylpropyl-dimethylazanium Traditional Name: 3-[2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]ammoniopropyl-dimethyl-ammonium Formula: C21H25ClN2O+2 MolecularWeight: 356.889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=[NH+]CCC[NH+](C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=[NH+]CCC[NH+](C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O/c1-15-5-10-20-18(13-15)19(23-11-4-12-24(2)3)14-21(25-20)16-6-8-17(22)9-7-16/h5-10,13-14H,4,11-12H2,1-3H3/p+2