6-chloranyl-7-methyl-4-[[[(2R)-4-phenylbutan-2-yl]amino]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[[(2R)-4-phenylbutan-2-yl]amino]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[[(1R)-1-methyl-3-phenyl-propyl]amino]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[[(2R)-4-phenylbutan-2-yl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[[(2R)-4-phenylbutan-2-yl]amino]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[(1R)-1-methyl-3-phenyl-propyl]amino]methyl]coumarin Formula: C21H22ClNO2 MolecularWeight: 355.85788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC(C)CCC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN[C@H](C)CCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H22ClNO2/c1-14-10-20-18(12-19(14)22)17(11-21(24)25-20)13-23-15(2)8-9-16-6-4-3-5-7-16/h3-7,10-12,15,23H,8-9,13H2,1-2H3/t15-/m1/s1