naphthalen-2-yl-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]methanone

Systemtic Name: naphthalen-2-yl-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]methanone Openeye Name: 2-naphthyl-[4-(8-nitro-5-isoquinolyl)piperazin-1-yl]methanone CAS Name: 2-naphthalenyl-[4-(8-nitro-5-isoquinolinyl)-1-piperazinyl]methanone IUPAC Name: naphthalen-2-yl-[4-(8-nitroisoquinolin-5-yl)piperazin-1-yl]methanone Traditional Name: 2-naphthyl-[4-(8-nitro-5-isoquinolyl)piperazino]methanone Formula: C24H20N4O3 MolecularWeight: 412.4406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H20N4O3/c29-24(19-6-5-17-3-1-2-4-18(17)15-19)27-13-11-26(12-14-27)22-7-8-23(28(30)31)21-16-25-10-9-20(21)22/h1-10,15-16H,11-14H2