3-(4-methoxyphenyl)-N-[2-(3-morpholin-4-ylpropylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[2-(3-morpholin-4-ylpropylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(4-methoxyphenyl)-N-[2-(3-morpholinopropylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[2-[3-(4-morpholinyl)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-N-[2-(3-morpholin-4-ylpropylamino)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-keto-2-(3-morpholinopropylamino)ethyl]-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NCCCN4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NCCCN4CCOCC4

InChI

InChI=1S/C25H29N5O5/c1-34-19-9-7-18(8-10-19)30-25(33)21-6-3-2-5-20(21)23(28-30)24(32)27-17-22(31)26-11-4-12-29-13-15-35-16-14-29/h2-3,5-10H,4,11-17H2,1H3,(H,26,31)(H,27,32)