4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one

Systemtic Name: 4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one Openeye Name: 4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one CAS Name: 4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one IUPAC Name: 4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one Traditional Name: 4-(cyclopentylamino)-8-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-1-one Formula: C20H18N6O3 MolecularWeight: 390.39532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N4C2=NN(C4=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N4C2=NN(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C20H18N6O3/c27-20-24-17-12-15(26(28)29)10-11-16(17)22-18(21-13-6-4-5-7-13)19(24)23-25(20)14-8-2-1-3-9-14/h1-3,8-13H,4-7H2,(H,21,22)