4-bromanyl-5-(3-methoxy-4-phenylmethoxy-phenyl)-2-(1-phenylethyl)pyridazin-3-one

Systemtic Name: 4-bromanyl-5-(3-methoxy-4-phenylmethoxy-phenyl)-2-(1-phenylethyl)pyridazin-3-one Openeye Name: 5-(4-benzyloxy-3-methoxy-phenyl)-4-bromo-2-(1-phenylethyl)pyridazin-3-one CAS Name: 4-bromo-5-(3-methoxy-4-phenylmethoxyphenyl)-2-(1-phenylethyl)-3-pyridazinone IUPAC Name: 4-bromo-5-(3-methoxy-4-phenylmethoxyphenyl)-2-(1-phenylethyl)pyridazin-3-one Traditional Name: 5-(4-benzoxy-3-methoxy-phenyl)-4-bromo-2-(1-phenylethyl)pyridazin-3-one Formula: C26H23BrN2O3 MolecularWeight: 491.37642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C(=C(C=N2)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)Br

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C(=C(C=N2)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)Br

InChI

InChI=1S/C26H23BrN2O3/c1-18(20-11-7-4-8-12-20)29-26(30)25(27)22(16-28-29)21-13-14-23(24(15-21)31-2)32-17-19-9-5-3-6-10-19/h3-16,18H,17H2,1-2H3