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

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

C1CNCCC1N(CC2=CC3=C(C=C2)OC=N3)C4=CC(=O)OC5=C4C=C(C=C5)Cl

Isomeric SMILES

C1CNCCC1N(CC2=CC3=C(C=C2)OC=N3)C4=CC(=O)OC5=C4C=C(C=C5)Cl

InChI

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