methyl 4-[(E)-3-(4-azanylidene-3-cyano-2-oxidanylidene-pentoxy)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(4-azanylidene-3-cyano-2-oxidanylidene-pentoxy)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(3-cyano-4-imino-2-oxo-pentoxy)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(3-cyano-4-imino-2-oxopentoxy)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(3-cyano-4-imino-2-oxopentoxy)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(3-cyano-4-imino-2-keto-pentoxy)-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C=CC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C17H16N2O5/c1-11(19)14(9-18)15(20)10-24-16(21)8-5-12-3-6-13(7-4-12)17(22)23-2/h3-8,14,19H,10H2,1-2H3/b8-5+,19-11?