methyl 2-[4-(4-methylphenoxy)butyl]-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxylate

Systemtic Name: methyl 2-[4-(4-methylphenoxy)butyl]-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxylate Openeye Name: methyl 2-[4-(4-methylphenoxy)butyl]-3-oxo-5,6-diphenyl-pyridazine-4-carboxylate CAS Name: 2-[4-(4-methylphenoxy)butyl]-3-oxo-5,6-diphenyl-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-methylphenoxy)butyl]-3-oxo-5,6-diphenylpyridazine-4-carboxylate Traditional Name: 3-keto-2-[4-(4-methylphenoxy)butyl]-5,6-diphenyl-pyridazine-4-carboxylic acid methyl ester Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCCN2C(=O)C(=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)OCCCCN2C(=O)C(=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C29H28N2O4/c1-21-15-17-24(18-16-21)35-20-10-9-19-31-28(32)26(29(33)34-2)25(22-11-5-3-6-12-22)27(30-31)23-13-7-4-8-14-23/h3-8,11-18H,9-10,19-20H2,1-2H3