3-butan-2-yl-4-methyl-2,6-dinitro-N-pentyl-aniline

Systemtic Name: 3-butan-2-yl-4-methyl-2,6-dinitro-N-pentyl-aniline Openeye Name: 4-methyl-2,6-dinitro-N-pentyl-3-sec-butyl-aniline CAS Name: 3-butan-2-yl-4-methyl-2,6-dinitro-N-pentylaniline IUPAC Name: 3-butan-2-yl-4-methyl-2,6-dinitro-N-pentylaniline Traditional Name: amyl-(4-methyl-2,6-dinitro-3-sec-butyl-phenyl)amine Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C(=C1[N+](=O)[O-])C(C)CC)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC1=C(C=C(C(=C1[N+](=O)[O-])C(C)CC)C)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O4/c1-5-7-8-9-17-15-13(18(20)21)10-12(4)14(11(3)6-2)16(15)19(22)23/h10-11,17H,5-9H2,1-4H3