6-chloranyl-7-methyl-4-[(4-pyrrolidin-1-ylcarbonylpiperidin-1-yl)methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[(4-pyrrolidin-1-ylcarbonylpiperidin-1-yl)methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[4-(pyrrolidine-1-carbonyl)-1-piperidyl]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[4-(pyrrolidine-1-carbonyl)piperidino]methyl]coumarin Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(=O)N4CCCC4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(=O)N4CCCC4)Cl

InChI

InChI=1S/C21H25ClN2O3/c1-14-10-19-17(12-18(14)22)16(11-20(25)27-19)13-23-8-4-15(5-9-23)21(26)24-6-2-3-7-24/h10-12,15H,2-9,13H2,1H3