3-(4-methoxyphenyl)-4-oxidanylidene-N-[2-oxidanylidene-2-(quinolin-3-ylamino)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-4-oxidanylidene-N-[2-oxidanylidene-2-(quinolin-3-ylamino)ethyl]phthalazine-1-carboxamide Openeye Name: 3-(4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(3-quinolylamino)ethyl]phthalazine-1-carboxamide CAS Name: 3-(4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(3-quinolinylamino)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(quinolin-3-ylamino)ethyl]phthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-keto-2-(3-quinolylamino)ethyl]-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C27H21N5O4 MolecularWeight: 479.48674

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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)NC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C27H21N5O4/c1-36-20-12-10-19(11-13-20)32-27(35)22-8-4-3-7-21(22)25(31-32)26(34)29-16-24(33)30-18-14-17-6-2-5-9-23(17)28-15-18/h2-15H,16H2,1H3,(H,29,34)(H,30,33)