3-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-oxo-2-[4-(8-quinolylmethyl)piperazin-1-yl]ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-oxo-2-[4-(8-quinolinylmethyl)-1-piperazinyl]ethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-oxo-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-keto-2-[4-(8-quinolylmethyl)piperazino]ethyl]-2H-phthalazine-1,4-quinone Formula: C24H23N5O3 MolecularWeight: 429.47112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C24H23N5O3/c30-21(16-29-24(32)20-9-2-1-8-19(20)23(31)26-29)28-13-11-27(12-14-28)15-18-6-3-5-17-7-4-10-25-22(17)18/h1-10H,11-16H2,(H,26,31)