N-[(2S)-butan-2-yl]-2,4-dinitro-aniline

Systemtic Name: N-[(2S)-butan-2-yl]-2,4-dinitro-aniline Openeye Name: N-[(1S)-1-methylpropyl]-2,4-dinitro-aniline CAS Name: N-[(2S)-butan-2-yl]-2,4-dinitroaniline IUPAC Name: N-[(2S)-butan-2-yl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(1S)-1-methylpropyl]amine Formula: C10H13N3O4 MolecularWeight: 239.22792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O4/c1-3-7(2)11-9-5-4-8(12(14)15)6-10(9)13(16)17/h4-7,11H,3H2,1-2H3/t7-/m0/s1