1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]propan-1-one

Systemtic Name: 1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]propan-1-one Openeye Name: 1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]propan-1-one CAS Name: 1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]-1-propanone IUPAC Name: 1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]propan-1-one Traditional Name: 1-[4-(2,4-dinitrophenyl)-2,2,4-trimethyl-6-nitro-3H-quinolin-1-yl]propan-1-one Formula: C21H22N4O7 MolecularWeight: 442.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(CC1(C)C)(C)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(CC1(C)C)(C)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O7/c1-5-19(26)22-17-9-7-13(23(27)28)10-16(17)21(4,12-20(22,2)3)15-8-6-14(24(29)30)11-18(15)25(31)32/h6-11H,5,12H2,1-4H3