[6-chloranyl-2-(4-methoxyphenyl)-7-methyl-chromen-4-ylidene]-(quinolin-2-ylamino)azanium

Systemtic Name: [6-chloranyl-2-(4-methoxyphenyl)-7-methyl-chromen-4-ylidene]-(quinolin-2-ylamino)azanium Openeye Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-chromen-4-ylidene]-(2-quinolylamino)ammonium CAS Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-1-benzopyran-4-ylidene]-(2-quinolinylamino)ammonium IUPAC Name: [6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]-(quinolin-2-ylamino)azanium Traditional Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-chromen-4-ylidene]-(2-quinolylamino)ammonium Formula: C26H21ClN3O2+ MolecularWeight: 442.91684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=CC2=[NH+]NC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=CC2=[NH+]NC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)OC)Cl

InChI

InChI=1S/C26H20ClN3O2/c1-16-13-25-20(14-21(16)27)23(15-24(32-25)18-7-10-19(31-2)11-8-18)29-30-26-12-9-17-5-3-4-6-22(17)28-26/h3-15H,1-2H3,(H,28,30)/p+1