[2-methyl-7-phenylmethoxy-1-(phenylmethyl)pyrrolo[2,3-d]pyridazin-3-yl]methyl ethanoate

Systemtic Name: [2-methyl-7-phenylmethoxy-1-(phenylmethyl)pyrrolo[2,3-d]pyridazin-3-yl]methyl ethanoate Openeye Name: (1-benzyl-7-benzyloxy-2-methyl-pyrrolo[2,3-d]pyridazin-3-yl)methyl acetate CAS Name: acetic acid [2-methyl-7-phenylmethoxy-1-(phenylmethyl)-3-pyrrolo[2,3-d]pyridazinyl]methyl ester IUPAC Name: (1-benzyl-2-methyl-7-phenylmethoxypyrrolo[2,3-d]pyridazin-3-yl)methyl acetate Traditional Name: acetic acid (7-benzoxy-1-benzyl-2-methyl-pyrrolo[2,3-d]pyridazin-3-yl)methyl ester Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CN=NC(=C2N1CC3=CC=CC=C3)OCC4=CC=CC=C4)COC(=O)C

Isomeric SMILES

CC1=C(C2=CN=NC(=C2N1CC3=CC=CC=C3)OCC4=CC=CC=C4)COC(=O)C

InChI

InChI=1S/C24H23N3O3/c1-17-22(16-29-18(2)28)21-13-25-26-24(30-15-20-11-7-4-8-12-20)23(21)27(17)14-19-9-5-3-6-10-19/h3-13H,14-16H2,1-2H3