6-chloranyl-7-methyl-4-[[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[4-[(3-methylisoxazol-5-yl)methyl]piperazino]methyl]coumarin Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC(=NO4)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCN(CC3)CC4=CC(=NO4)C)Cl

InChI

InChI=1S/C20H22ClN3O3/c1-13-7-19-17(10-18(13)21)15(9-20(25)26-19)11-23-3-5-24(6-4-23)12-16-8-14(2)22-27-16/h7-10H,3-6,11-12H2,1-2H3