[(2,4-dinitrophenyl)-(propan-2-ylcarbamoyl)amino] methyl carbonate

Systemtic Name: [(2,4-dinitrophenyl)-(propan-2-ylcarbamoyl)amino] methyl carbonate Openeye Name: [N-(isopropylcarbamoyl)-2,4-dinitro-anilino] methyl carbonate CAS Name: carbonic acid (2,4-dinitro-N-[oxo-(propan-2-ylamino)methyl]anilino) methyl ester IUPAC Name: [2,4-dinitro-N-(propan-2-ylcarbamoyl)anilino] methyl carbonate Traditional Name: carbonic acid [N-(isopropylcarbamoyl)-2,4-dinitro-anilino] methyl ester Formula: C12H14N4O8 MolecularWeight: 342.26156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O8/c1-7(2)13-11(17)14(24-12(18)23-3)9-5-4-8(15(19)20)6-10(9)16(21)22/h4-7H,1-3H3,(H,13,17)