1-methyl-5-nitro-2-(2-oxidanylidenepropyl)indole-3-carbaldehyde

Systemtic Name: 1-methyl-5-nitro-2-(2-oxidanylidenepropyl)indole-3-carbaldehyde Openeye Name: 2-acetonyl-1-methyl-5-nitro-indole-3-carbaldehyde CAS Name: 1-methyl-5-nitro-2-(2-oxopropyl)-3-indolecarboxaldehyde IUPAC Name: 1-methyl-5-nitro-2-(2-oxopropyl)indole-3-carbaldehyde Traditional Name: 2-acetonyl-1-methyl-5-nitro-indole-3-carbaldehyde Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])C=O

Isomeric SMILES

CC(=O)CC1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C13H12N2O4/c1-8(17)5-13-11(7-16)10-6-9(15(18)19)3-4-12(10)14(13)2/h3-4,6-7H,5H2,1-2H3