bis(6-butan-2-yl-1-chloranyl-4-nitro-cyclohexa-2,4-dien-1-yl) carbonate

Systemtic Name: bis(6-butan-2-yl-1-chloranyl-4-nitro-cyclohexa-2,4-dien-1-yl) carbonate Openeye Name: bis(1-chloro-4-nitro-6-sec-butyl-cyclohexa-2,4-dien-1-yl) carbonate CAS Name: carbonic acid bis(6-butan-2-yl-1-chloro-4-nitro-1-cyclohexa-2,4-dienyl) ester IUPAC Name: bis(6-butan-2-yl-1-chloro-4-nitrocyclohexa-2,4-dien-1-yl) carbonate Traditional Name: carbonic acid bis(1-chloro-4-nitro-6-sec-butyl-cyclohexa-2,4-dien-1-yl) ester Formula: C21H26Cl2N2O7 MolecularWeight: 489.34634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C=C(C=CC1(OC(=O)OC2(C=CC(=CC2C(C)CC)[N+](=O)[O-])Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1C=C(C=CC1(OC(=O)OC2(C=CC(=CC2C(C)CC)[N+](=O)[O-])Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H26Cl2N2O7/c1-5-13(3)17-11-15(24(27)28)7-9-20(17,22)31-19(26)32-21(23)10-8-16(25(29)30)12-18(21)14(4)6-2/h7-14,17-18H,5-6H2,1-4H3