4-oxidanylidene-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[1-(phenylcarbamoyl)-4-piperidyl]-3H-phthalazine-1-carboxamide CAS Name: N-[1-[anilino(oxo)methyl]-4-piperidinyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[1-(phenylcarbamoyl)piperidin-4-yl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[1-(phenylcarbamoyl)-4-piperidyl]-3H-phthalazine-1-carboxamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=NNC(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=NNC(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O3/c27-19-17-9-5-4-8-16(17)18(24-25-19)20(28)22-15-10-12-26(13-11-15)21(29)23-14-6-2-1-3-7-14/h1-9,15H,10-13H2,(H,22,28)(H,23,29)(H,25,27)