6-chloranyl-7-methyl-4-[[(4-oxidanylcyclohexyl)amino]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[(4-oxidanylcyclohexyl)amino]methyl]chromen-2-one Openeye Name: 6-chloro-4-[[(4-hydroxycyclohexyl)amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[(4-hydroxycyclohexyl)amino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[(4-hydroxycyclohexyl)amino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[(4-hydroxycyclohexyl)amino]methyl]-7-methyl-coumarin Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3CCC(CC3)O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3CCC(CC3)O)Cl

InChI

InChI=1S/C17H20ClNO3/c1-10-6-16-14(8-15(10)18)11(7-17(21)22-16)9-19-12-2-4-13(20)5-3-12/h6-8,12-13,19-20H,2-5,9H2,1H3