1-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]-(1H-pyrrol-3-yl)methyl]-3-phenyl-urea

Systemtic Name: 1-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]-(1H-pyrrol-3-yl)methyl]-3-phenyl-urea Openeye Name: 1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-(1H-pyrrol-3-yl)methyl]-3-phenyl-urea CAS Name: 1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-(1H-pyrrol-3-yl)methyl]-3-phenylurea IUPAC Name: 1-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-(1H-pyrrol-3-yl)methyl]-3-phenylurea Traditional Name: 1-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-6-yl)-(1H-pyrrol-3-yl)methyl]-3-phenyl-urea Formula: C20H16N6O5 MolecularWeight: 420.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC(C2=CNC=C2)C3=CC4=C(C=C3[N+](=O)[O-])NC(=O)C(=O)N4

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC(C2=CNC=C2)C3=CC4=C(C=C3[N+](=O)[O-])NC(=O)C(=O)N4

InChI

InChI=1S/C20H16N6O5/c27-18-19(28)24-15-9-16(26(30)31)13(8-14(15)23-18)17(11-6-7-21-10-11)25-20(29)22-12-4-2-1-3-5-12/h1-10,17,21H,(H,23,27)(H,24,28)(H2,22,25,29)