[4-[(E)-3-(butylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] 2,6-dimethoxybenzoate

Systemtic Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] 2,6-dimethoxybenzoate Openeye Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxo-prop-1-enyl]phenyl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(butylamino)-2-cyano-3-oxoprop-1-enyl]phenyl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid [4-[(E)-3-(butylamino)-2-cyano-3-keto-prop-1-enyl]phenyl] ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=C(C=CC=C2OC)OC)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CC=C(C=C1)OC(=O)C2=C(C=CC=C2OC)OC)/C#N

InChI

InChI=1S/C23H24N2O5/c1-4-5-13-25-22(26)17(15-24)14-16-9-11-18(12-10-16)30-23(27)21-19(28-2)7-6-8-20(21)29-3/h6-12,14H,4-5,13H2,1-3H3,(H,25,26)/b17-14+