6-chloranyl-8-(dimethylaminomethyl)-7-oxidanyl-4-phenyl-chromen-2-one dihydrochloride

Systemtic Name: 6-chloranyl-8-(dimethylaminomethyl)-7-oxidanyl-4-phenyl-chromen-2-one dihydrochloride Openeye Name: 6-chloro-8-(dimethylaminomethyl)-7-hydroxy-4-phenyl-chromen-2-one dihydrochloride CAS Name: 6-chloro-8-(dimethylaminomethyl)-7-hydroxy-4-phenyl-1-benzopyran-2-one dihydrochloride IUPAC Name: 6-chloro-8-(dimethylaminomethyl)-7-hydroxy-4-phenylchromen-2-one dihydrochloride Traditional Name: 6-chloro-8-(dimethylaminomethyl)-7-hydroxy-4-phenyl-coumarin dihydrochloride Formula: C18H18Cl3NO3 MolecularWeight: 402.69942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CN(C)CC1=C2C(=CC(=C1O)Cl)C(=CC(=O)O2)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C18H16ClNO3.2ClH/c1-20(2)10-14-17(22)15(19)8-13-12(9-16(21)23-18(13)14)11-6-4-3-5-7-11;;/h3-9,22H,10H2,1-2H3;2*1H