3,4-dimethyl-7-[4-(methylamino)butoxy]chromen-2-one hydrochloride

Systemtic Name: 3,4-dimethyl-7-[4-(methylamino)butoxy]chromen-2-one hydrochloride Openeye Name: 3,4-dimethyl-7-[4-(methylamino)butoxy]chromen-2-one hydrochloride CAS Name: 3,4-dimethyl-7-[4-(methylamino)butoxy]-1-benzopyran-2-one hydrochloride IUPAC Name: 3,4-dimethyl-7-[4-(methylamino)butoxy]chromen-2-one hydrochloride Traditional Name: 3,4-dimethyl-7-[4-(methylamino)butoxy]coumarin hydrochloride Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCCCCNC)C.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCCCCNC)C.Cl

InChI

InChI=1S/C16H21NO3.ClH/c1-11-12(2)16(18)20-15-10-13(6-7-14(11)15)19-9-5-4-8-17-3;/h6-7,10,17H,4-5,8-9H2,1-3H3;1H