4-[[1-(1,3-benzoxazol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one

Systemtic Name: 4-[[1-(1,3-benzoxazol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-chromen-2-one Openeye Name: 4-[[1-(1,3-benzoxazol-5-ylmethyl)-4-piperidyl]amino]-6-chloro-chromen-2-one CAS Name: 4-[[1-(1,3-benzoxazol-5-ylmethyl)-4-piperidinyl]amino]-6-chloro-1-benzopyran-2-one IUPAC Name: 4-[[1-(1,3-benzoxazol-5-ylmethyl)piperidin-4-yl]amino]-6-chlorochromen-2-one Traditional Name: 4-[[1-(1,3-benzoxazol-5-ylmethyl)-4-piperidyl]amino]-6-chloro-coumarin Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)OC=N5

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)OC=N5

InChI

InChI=1S/C22H20ClN3O3/c23-15-2-4-20-17(10-15)18(11-22(27)29-20)25-16-5-7-26(8-6-16)12-14-1-3-21-19(9-14)24-13-28-21/h1-4,9-11,13,16,25H,5-8,12H2