1-(4-butoxycyclohexyl)-2,3-dinitro-4-pentyl-benzene

Systemtic Name: 1-(4-butoxycyclohexyl)-2,3-dinitro-4-pentyl-benzene Openeye Name: 1-(4-butoxycyclohexyl)-2,3-dinitro-4-pentyl-benzene CAS Name: 1-(4-butoxycyclohexyl)-2,3-dinitro-4-pentylbenzene IUPAC Name: 1-(4-butoxycyclohexyl)-2,3-dinitro-4-pentylbenzene Traditional Name: 1-amyl-4-(4-butoxycyclohexyl)-2,3-dinitro-benzene Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)C2CCC(CC2)OCCCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)C2CCC(CC2)OCCCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H32N2O5/c1-3-5-7-8-17-11-14-19(21(23(26)27)20(17)22(24)25)16-9-12-18(13-10-16)28-15-6-4-2/h11,14,16,18H,3-10,12-13,15H2,1-2H3