N-(1-cyclopropylcarbonylpiperidin-4-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(1-cyclopropylcarbonylpiperidin-4-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-keto-phthalazine-1-carboxamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC(CC2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)N2CCC(CC2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3/c30-23(26-19-12-14-28(15-13-19)24(31)18-10-11-18)22-20-8-4-5-9-21(20)25(32)29(27-22)16-17-6-2-1-3-7-17/h1-9,18-19H,10-16H2,(H,26,30)