6-chloranyl-7-methyl-4-[(3-oxidanylpiperidin-1-yl)methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[(3-oxidanylpiperidin-1-yl)methyl]chromen-2-one Openeye Name: 6-chloro-4-[(3-hydroxy-1-piperidyl)methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[(3-hydroxy-1-piperidinyl)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[(3-hydroxypiperidin-1-yl)methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[(3-hydroxypiperidino)methyl]-7-methyl-coumarin Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCCC(C3)O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCCC(C3)O)Cl

InChI

InChI=1S/C16H18ClNO3/c1-10-5-15-13(7-14(10)17)11(6-16(20)21-15)8-18-4-2-3-12(19)9-18/h5-7,12,19H,2-4,8-9H2,1H3