methyl 3-(1-methyl-5-nitro-indol-4-yl)propanoate

Systemtic Name: methyl 3-(1-methyl-5-nitro-indol-4-yl)propanoate Openeye Name: methyl 3-(1-methyl-5-nitro-indol-4-yl)propanoate CAS Name: 3-(1-methyl-5-nitro-4-indolyl)propanoic acid methyl ester IUPAC Name: methyl 3-(1-methyl-5-nitroindol-4-yl)propanoate Traditional Name: 3-(1-methyl-5-nitro-indol-4-yl)propionic acid methyl ester Formula: C13H14N2O4 MolecularWeight: 262.26126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2CCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2CCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4/c1-14-8-7-10-9(3-6-13(16)19-2)12(15(17)18)5-4-11(10)14/h4-5,7-8H,3,6H2,1-2H3