6-chloranyl-8-[(2-hydroxyethylamino)methyl]-3,4-dimethyl-7-oxidanyl-chromen-2-one hydrochloride

Systemtic Name: 6-chloranyl-8-[(2-hydroxyethylamino)methyl]-3,4-dimethyl-7-oxidanyl-chromen-2-one hydrochloride Openeye Name: 6-chloro-7-hydroxy-8-[(2-hydroxyethylamino)methyl]-3,4-dimethyl-chromen-2-one hydrochloride CAS Name: 6-chloro-7-hydroxy-8-[(2-hydroxyethylamino)methyl]-3,4-dimethyl-1-benzopyran-2-one hydrochloride IUPAC Name: 6-chloro-7-hydroxy-8-[(2-hydroxyethylamino)methyl]-3,4-dimethylchromen-2-one hydrochloride Traditional Name: 6-chloro-7-hydroxy-8-[(2-hydroxyethylamino)methyl]-3,4-dimethyl-coumarin hydrochloride Formula: C14H17Cl2NO4 MolecularWeight: 334.19508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CNCCO)C.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CNCCO)C.Cl

InChI

InChI=1S/C14H16ClNO4.ClH/c1-7-8(2)14(19)20-13-9(7)5-11(15)12(18)10(13)6-16-3-4-17;/h5,16-18H,3-4,6H2,1-2H3;1H