(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C20H21ClNO3+ MolecularWeight: 358.83864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CCC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CCC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C20H20ClNO3/c1-13-9-19-17(11-18(13)21)15(10-20(23)25-19)12-22-8-7-14-3-5-16(24-2)6-4-14/h3-6,9-11,22H,7-8,12H2,1-2H3/p+1