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

Systemtic Name: 2-[3-(4-methylphenoxy)propyl]-3-oxidanylidene-5,6-diphenyl-pyridazine-4-carboxylate Openeye Name: 2-[3-(4-methylphenoxy)propyl]-3-oxo-5,6-diphenyl-pyridazine-4-carboxylate CAS Name: 2-[3-(4-methylphenoxy)propyl]-3-oxo-5,6-diphenyl-4-pyridazinecarboxylate IUPAC Name: 2-[3-(4-methylphenoxy)propyl]-3-oxo-5,6-diphenylpyridazine-4-carboxylate Traditional Name: 3-keto-2-[3-(4-methylphenoxy)propyl]-5,6-diphenyl-pyridazine-4-carboxylate Formula: C27H23N2O4- MolecularWeight: 439.48252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCN2C(=O)C(=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCCN2C(=O)C(=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C27H24N2O4/c1-19-13-15-22(16-14-19)33-18-8-17-29-26(30)24(27(31)32)23(20-9-4-2-5-10-20)25(28-29)21-11-6-3-7-12-21/h2-7,9-16H,8,17-18H2,1H3,(H,31,32)/p-1