(phenylmethyl) N-[6-(4-methoxyphenyl)-3-oxidanylidene-2-(3-phenylpropyl)pyridazin-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[6-(4-methoxyphenyl)-3-oxidanylidene-2-(3-phenylpropyl)pyridazin-4-yl]carbamate Openeye Name: benzyl N-[6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)pyridazin-4-yl]carbamate CAS Name: N-[6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)-4-pyridazinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-(4-methoxyphenyl)-3-oxo-2-(3-phenylpropyl)pyridazin-4-yl]carbamate Traditional Name: N-[3-keto-6-(4-methoxyphenyl)-2-(3-phenylpropyl)pyridazin-4-yl]carbamic acid benzyl ester Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)NC(=O)OCC3=CC=CC=C3)CCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)NC(=O)OCC3=CC=CC=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4/c1-34-24-16-14-23(15-17-24)25-19-26(29-28(33)35-20-22-11-6-3-7-12-22)27(32)31(30-25)18-8-13-21-9-4-2-5-10-21/h2-7,9-12,14-17,19H,8,13,18,20H2,1H3,(H,29,33)