4-azanyl-4-(2,2-dimethylpropyl)-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione

Systemtic Name: 4-azanyl-4-(2,2-dimethylpropyl)-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione Openeye Name: 4-amino-4-(2,2-dimethylpropyl)-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione CAS Name: 4-amino-4-(2,2-dimethylpropyl)-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione IUPAC Name: 4-amino-4-(2,2-dimethylpropyl)-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione Traditional Name: 4-amino-4-neopentyl-2-(4-nitrophenyl)hepta-1,6-diene-3,5-dione Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)C=C)(C(=O)C(=C)C1=CC=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)CC(C(=O)C=C)(C(=O)C(=C)C1=CC=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C18H22N2O4/c1-6-15(21)18(19,11-17(3,4)5)16(22)12(2)13-7-9-14(10-8-13)20(23)24/h6-10H,1-2,11,19H2,3-5H3