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

Systemtic Name: 6-chloranyl-8-[(cyclopentylamino)methyl]-3,4-dimethyl-7-oxidanyl-chromen-2-one hydrochloride Openeye Name: 6-chloro-8-[(cyclopentylamino)methyl]-7-hydroxy-3,4-dimethyl-chromen-2-one hydrochloride CAS Name: 6-chloro-8-[(cyclopentylamino)methyl]-7-hydroxy-3,4-dimethyl-1-benzopyran-2-one hydrochloride IUPAC Name: 6-chloro-8-[(cyclopentylamino)methyl]-7-hydroxy-3,4-dimethylchromen-2-one hydrochloride Traditional Name: 6-chloro-8-[(cyclopentylamino)methyl]-7-hydroxy-3,4-dimethyl-coumarin hydrochloride Formula: C17H21Cl2NO3 MolecularWeight: 358.25954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CNC3CCCC3)C.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CNC3CCCC3)C.Cl

InChI

InChI=1S/C17H20ClNO3.ClH/c1-9-10(2)17(21)22-16-12(9)7-14(18)15(20)13(16)8-19-11-5-3-4-6-11;/h7,11,19-20H,3-6,8H2,1-2H3;1H