3-[2-[bis(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[2-[bis(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[2-[bis(4-methoxyphenyl)methylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[2-[bis(4-methoxyphenyl)methylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[2-[bis(4-methoxyphenyl)methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-[2-[bis(4-methoxyphenyl)methylamino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylic acid Formula: C26H23N3O6 MolecularWeight: 473.47732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)O

InChI

InChI=1S/C26H23N3O6/c1-34-18-11-7-16(8-12-18)23(17-9-13-19(35-2)14-10-17)27-22(30)15-29-25(31)21-6-4-3-5-20(21)24(28-29)26(32)33/h3-14,23H,15H2,1-2H3,(H,27,30)(H,32,33)