4-oxidanylidene-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[3-(2-oxoazepan-1-yl)propyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-(2-oxo-1-azepanyl)propyl]-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[3-(2-oxoazepan-1-yl)propyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[3-(2-ketoazepan-1-yl)propyl]phthalazine-1-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3/c30-22-14-5-2-8-16-28(22)17-9-15-26-24(31)23-20-12-6-7-13-21(20)25(32)29(27-23)18-19-10-3-1-4-11-19/h1,3-4,6-7,10-13H,2,5,8-9,14-18H2,(H,26,31)