6-chloranyl-7-methyl-4-[[[(2R)-oxolan-2-yl]methylamino]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[[(2R)-oxolan-2-yl]methylamino]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[[(2R)-tetrahydrofuran-2-yl]methylamino]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[[(2R)-2-oxolanyl]methylamino]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[[(2R)-oxolan-2-yl]methylamino]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[(2R)-tetrahydrofuran-2-yl]methylamino]methyl]coumarin Formula: C16H18ClNO3 MolecularWeight: 307.77202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNCC3CCCO3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC[C@H]3CCCO3)Cl

InChI

InChI=1S/C16H18ClNO3/c1-10-5-15-13(7-14(10)17)11(6-16(19)21-15)8-18-9-12-3-2-4-20-12/h5-7,12,18H,2-4,8-9H2,1H3/t12-/m1/s1