ethyl 2-[(6-methoxy-3-nitro-1H-indol-2-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(6-methoxy-3-nitro-1H-indol-2-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(6-methoxy-3-nitro-1H-indol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-methoxy-3-nitro-1H-indol-2-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6-methoxy-3-nitro-1H-indol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-methoxy-3-nitro-1H-indol-2-yl)thio]acetic acid ethyl ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C2=C(N1)C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC1=C(C2=C(N1)C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5S/c1-3-20-11(16)7-21-13-12(15(17)18)9-5-4-8(19-2)6-10(9)14-13/h4-6,14H,3,7H2,1-2H3