N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-[(2-methoxyanilino)-oxomethyl]phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]phthalazine-1-carboxamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C28H28N4O4/c1-3-4-9-18-32-28(35)22-11-6-5-10-21(22)25(31-32)27(34)29-20-16-14-19(15-17-20)26(33)30-23-12-7-8-13-24(23)36-2/h5-8,10-17H,3-4,9,18H2,1-2H3,(H,29,34)(H,30,33)