6-[[(2-chlorophenyl)methylamino]methyl]-4-(4-methoxyphenyl)-8-methyl-7-oxidanyl-chromen-2-one hydrochloride

Systemtic Name: 6-[[(2-chlorophenyl)methylamino]methyl]-4-(4-methoxyphenyl)-8-methyl-7-oxidanyl-chromen-2-one hydrochloride Openeye Name: 6-[[(2-chlorophenyl)methylamino]methyl]-7-hydroxy-4-(4-methoxyphenyl)-8-methyl-chromen-2-one hydrochloride CAS Name: 6-[[(2-chlorophenyl)methylamino]methyl]-7-hydroxy-4-(4-methoxyphenyl)-8-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 6-[[(2-chlorophenyl)methylamino]methyl]-7-hydroxy-4-(4-methoxyphenyl)-8-methylchromen-2-one hydrochloride Traditional Name: 6-[[(2-chlorobenzyl)amino]methyl]-7-hydroxy-4-(4-methoxyphenyl)-8-methyl-coumarin hydrochloride Formula: C25H23Cl2NO4 MolecularWeight: 472.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CNCC3=CC=CC=C3Cl)C(=CC(=O)O2)C4=CC=C(C=C4)OC.Cl

Isomeric SMILES

CC1=C2C(=CC(=C1O)CNCC3=CC=CC=C3Cl)C(=CC(=O)O2)C4=CC=C(C=C4)OC.Cl

InChI

InChI=1S/C25H22ClNO4.ClH/c1-15-24(29)18(14-27-13-17-5-3-4-6-22(17)26)11-21-20(12-23(28)31-25(15)21)16-7-9-19(30-2)10-8-16;/h3-12,27,29H,13-14H2,1-2H3;1H