6-[3-(aminomethyl)pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione

Systemtic Name: 6-[3-(aminomethyl)pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione Openeye Name: 6-[3-(aminomethyl)pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione CAS Name: 6-[3-(aminomethyl)-1-pyrrolyl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione IUPAC Name: 6-[3-(aminomethyl)pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-dione Traditional Name: 6-[3-(aminomethyl)pyrrol-1-yl]-4-cyclohexyl-7-nitro-1H-quinoxaline-2,3-quinone Formula: C19H21N5O4 MolecularWeight: 383.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=CC(=C(C=C3NC(=O)C2=O)[N+](=O)[O-])N4C=CC(=C4)CN

Isomeric SMILES

C1CCC(CC1)N2C3=CC(=C(C=C3NC(=O)C2=O)[N+](=O)[O-])N4C=CC(=C4)CN

InChI

InChI=1S/C19H21N5O4/c20-10-12-6-7-22(11-12)16-9-15-14(8-17(16)24(27)28)21-18(25)19(26)23(15)13-4-2-1-3-5-13/h6-9,11,13H,1-5,10,20H2,(H,21,25)