3-nitro-N-(2-quinolin-8-ylethyl)-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: 3-nitro-N-(2-quinolin-8-ylethyl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: 3-nitro-N-[2-(8-quinolyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: 3-nitro-N-[2-(8-quinolinyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: 3-nitro-N-(2-quinolin-8-ylethyl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: 3-nitro-N-[2-(8-quinolyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C20H16N6O3 MolecularWeight: 388.37944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCNC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCNC(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C20H16N6O3/c27-20(23-10-8-15-4-1-3-14-5-2-9-22-19(14)15)16-6-7-17(18(11-16)26(28)29)25-13-21-12-24-25/h1-7,9,11-13H,8,10H2,(H,23,27)