4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)pyridazin-3-one

Systemtic Name: 4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)pyridazin-3-one Openeye Name: 4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxy-phenyl)pyridazin-3-one CAS Name: 4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxyphenyl)-3-pyridazinone IUPAC Name: 4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxyphenyl)pyridazin-3-one Traditional Name: 4-(aminomethyl)-2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxy-phenyl)pyridazin-3-one Formula: C18H22FN3O2 MolecularWeight: 331.384583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CN)CC3CCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CN)CC3CCCC3)F

InChI

InChI=1S/C18H22FN3O2/c1-24-17-7-6-13(8-15(17)19)16-9-14(10-20)18(23)22(21-16)11-12-4-2-3-5-12/h6-9,12H,2-5,10-11,20H2,1H3