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

Systemtic Name: ethyl 3-(4-methyl-5-nitro-1H-indol-3-yl)propanoate Openeye Name: ethyl 3-(4-methyl-5-nitro-1H-indol-3-yl)propanoate CAS Name: 3-(4-methyl-5-nitro-1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-methyl-5-nitro-1H-indol-3-yl)propanoate Traditional Name: 3-(4-methyl-5-nitro-1H-indol-3-yl)propionic acid ethyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CNC2=C1C(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCC1=CNC2=C1C(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H16N2O4/c1-3-20-13(17)7-4-10-8-15-11-5-6-12(16(18)19)9(2)14(10)11/h5-6,8,15H,3-4,7H2,1-2H3