4-[(3-fluoranyl-4-methoxy-phenyl)methyl-piperidin-4-yl-amino]-6-methoxy-chromen-2-one

Systemtic Name: 4-[(3-fluoranyl-4-methoxy-phenyl)methyl-piperidin-4-yl-amino]-6-methoxy-chromen-2-one Openeye Name: 4-[(3-fluoro-4-methoxy-phenyl)methyl-(4-piperidyl)amino]-6-methoxy-chromen-2-one CAS Name: 4-[(3-fluoro-4-methoxyphenyl)methyl-(4-piperidinyl)amino]-6-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(3-fluoro-4-methoxyphenyl)methyl-piperidin-4-ylamino]-6-methoxychromen-2-one Traditional Name: 4-[(3-fluoro-4-methoxy-benzyl)-(4-piperidyl)amino]-6-methoxy-coumarin Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=C(C=C3)OC)F)C4CCNCC4

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=C(C=C3)OC)F)C4CCNCC4

InChI

InChI=1S/C23H25FN2O4/c1-28-17-4-6-21-18(12-17)20(13-23(27)30-21)26(16-7-9-25-10-8-16)14-15-3-5-22(29-2)19(24)11-15/h3-6,11-13,16,25H,7-10,14H2,1-2H3