2-[2-(1-azanyl-2-methyl-propan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-(1-azanyl-2-methyl-propan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindole-1,3-dione Openeye Name: 2-[2-(2-amino-1,1-dimethyl-ethyl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindoline-1,3-dione CAS Name: 2-[2-(1-amino-2-methylpropan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindole-1,3-dione IUPAC Name: 2-[2-(1-amino-2-methylpropan-2-yl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindole-1,3-dione Traditional Name: 2-[2-(2-amino-1,1-dimethyl-ethyl)-6-nitro-1,2,3,4-tetrahydroquinolin-4-yl]isoindoline-1,3-quinone Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)C1CC(C2=C(N1)C=CC(=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(CN)C1CC(C2=C(N1)C=CC(=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H22N4O4/c1-21(2,11-22)18-10-17(15-9-12(25(28)29)7-8-16(15)23-18)24-19(26)13-5-3-4-6-14(13)20(24)27/h3-9,17-18,23H,10-11,22H2,1-2H3