propan-2-yl N-(4-methylsulfonyl-2,6-dinitro-phenyl)-N-propyl-carbamate

Systemtic Name: propan-2-yl N-(4-methylsulfonyl-2,6-dinitro-phenyl)-N-propyl-carbamate Openeye Name: isopropyl N-(4-methylsulfonyl-2,6-dinitro-phenyl)-N-propyl-carbamate CAS Name: N-(4-methylsulfonyl-2,6-dinitrophenyl)-N-propylcarbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-(4-methylsulfonyl-2,6-dinitrophenyl)-N-propylcarbamate Traditional Name: N-(4-mesyl-2,6-dinitro-phenyl)-N-propyl-carbamic acid isopropyl ester Formula: C14H19N3O8S MolecularWeight: 389.38096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CCCN(C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C14H19N3O8S/c1-5-6-15(14(18)25-9(2)3)13-11(16(19)20)7-10(26(4,23)24)8-12(13)17(21)22/h7-9H,5-6H2,1-4H3