2-methoxyethyl 3-[[[1,3-bis(oxidanylidene)inden-2-ylidene]-cyano-methyl]amino]benzoate

Systemtic Name: 2-methoxyethyl 3-[[[1,3-bis(oxidanylidene)inden-2-ylidene]-cyano-methyl]amino]benzoate Openeye Name: 2-methoxyethyl 3-[[cyano-(1,3-dioxoindan-2-ylidene)methyl]amino]benzoate CAS Name: 3-[[cyano-(1,3-dioxo-2-indenylidene)methyl]amino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-[[cyano-(1,3-dioxoinden-2-ylidene)methyl]amino]benzoate Traditional Name: 3-[[cyano-(1,3-diketoindan-2-ylidene)methyl]amino]benzoic acid 2-methoxyethyl ester Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC(=CC=C1)NC(=C2C(=O)C3=CC=CC=C3C2=O)C#N

Isomeric SMILES

COCCOC(=O)C1=CC(=CC=C1)NC(=C2C(=O)C3=CC=CC=C3C2=O)C#N

InChI

InChI=1S/C21H16N2O5/c1-27-9-10-28-21(26)13-5-4-6-14(11-13)23-17(12-22)18-19(24)15-7-2-3-8-16(15)20(18)25/h2-8,11,23H,9-10H2,1H3