5-butoxy-2-(phenylmethyl)-1H-indazol-3-one

Systemtic Name: 5-butoxy-2-(phenylmethyl)-1H-indazol-3-one Openeye Name: 2-benzyl-5-butoxy-1H-indazol-3-one CAS Name: 5-butoxy-2-(phenylmethyl)-1H-indazol-3-one IUPAC Name: 2-benzyl-5-butoxy-1H-indazol-3-one Traditional Name: 2-benzyl-5-butoxy-indazolin-3-one Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)NN(C2=O)CC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)NN(C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2/c1-2-3-11-22-15-9-10-17-16(12-15)18(21)20(19-17)13-14-7-5-4-6-8-14/h4-10,12,19H,2-3,11,13H2,1H3