N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: 2-(1-keto-2-isoquinolyl)-N-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]acetamide Formula: C24H25N5O5 MolecularWeight: 463.4858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCNC(=O)CN3C=CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCNC(=O)CN3C=CC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25N5O5/c30-22(17-28-12-10-18-3-1-2-4-21(18)24(28)32)25-11-9-23(31)27-15-13-26(14-16-27)19-5-7-20(8-6-19)29(33)34/h1-8,10,12H,9,11,13-17H2,(H,25,30)