methyl 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitro-benzoate

Systemtic Name: methyl 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitro-benzoate Openeye Name: methyl 2-(6-methoxyindan-5-yl)-3-nitro-benzoate CAS Name: 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitrobenzoate Traditional Name: 2-(6-methoxyindan-5-yl)-3-nitro-benzoic acid methyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC2)C=C1C3=C(C=CC=C3[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC2=C(CCC2)C=C1C3=C(C=CC=C3[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H17NO5/c1-23-16-10-12-6-3-5-11(12)9-14(16)17-13(18(20)24-2)7-4-8-15(17)19(21)22/h4,7-10H,3,5-6H2,1-2H3