(6aR,8S,9S)-9-(phenylcarbonyl)-8-pyridin-3-yl-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile

Systemtic Name: (6aR,8S,9S)-9-(phenylcarbonyl)-8-pyridin-3-yl-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile Openeye Name: (6aR,8S,9S)-9-benzoyl-8-(3-pyridyl)-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile CAS Name: (6aR,8S,9S)-9-benzoyl-8-(3-pyridinyl)-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile IUPAC Name: (6aR,8S,9S)-9-benzoyl-8-pyridin-3-yl-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile Traditional Name: (6aR,8S,9S)-9-benzoyl-8-(3-pyridyl)-8,9-dihydro-6aH-pyrrolo[1,2-a][1,5]naphthyridine-7,7-dicarbonitrile Formula: C25H17N5O MolecularWeight: 403.43538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(C(C3N2C4=C(C=C3)N=CC=C4)(C#N)C#N)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[C@@H]2[C@H](C([C@@H]3N2C4=C(C=C3)N=CC=C4)(C#N)C#N)C5=CN=CC=C5

InChI

InChI=1S/C25H17N5O/c26-15-25(16-27)21-11-10-19-20(9-5-13-29-19)30(21)23(22(25)18-8-4-12-28-14-18)24(31)17-6-2-1-3-7-17/h1-14,21-23H/t21-,22-,23+/m1/s1