4-azanyl-3-nitro-1-phenyl-butan-1-one

Systemtic Name: 4-azanyl-3-nitro-1-phenyl-butan-1-one Openeye Name: 4-amino-3-nitro-1-phenyl-butan-1-one CAS Name: 4-amino-3-nitro-1-phenyl-1-butanone IUPAC Name: 4-amino-3-nitro-1-phenylbutan-1-one Traditional Name: 4-amino-3-nitro-1-phenyl-butan-1-one Formula: C10H12N2O3 MolecularWeight: 208.21388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O3/c11-7-9(12(14)15)6-10(13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2