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

Systemtic Name: methyl 3-(5-nitro-3-pyridin-3-yl-indol-1-yl)propanoate Openeye Name: methyl 3-[5-nitro-3-(3-pyridyl)indol-1-yl]propanoate CAS Name: 3-[5-nitro-3-(3-pyridinyl)-1-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(5-nitro-3-pyridin-3-ylindol-1-yl)propanoate Traditional Name: 3-[5-nitro-3-(3-pyridyl)indol-1-yl]propionic acid methyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CN=CC=C3

Isomeric SMILES

COC(=O)CCN1C=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CN=CC=C3

InChI

InChI=1S/C17H15N3O4/c1-24-17(21)6-8-19-11-15(12-3-2-7-18-10-12)14-9-13(20(22)23)4-5-16(14)19/h2-5,7,9-11H,6,8H2,1H3