undecyl 4-[[(E)-[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]amino]benzoate

Systemtic Name: undecyl 4-[[(E)-[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]amino]benzoate Openeye Name: undecyl 4-[[(E)-(6-methyl-2,4-dioxo-pyran-3-ylidene)methyl]amino]benzoate CAS Name: 4-[[(E)-(6-methyl-2,4-dioxo-3-pyranylidene)methyl]amino]benzoic acid undecyl ester IUPAC Name: undecyl 4-[[(E)-(6-methyl-2,4-dioxopyran-3-ylidene)methyl]amino]benzoate Traditional Name: 4-[[(E)-(2,4-diketo-6-methyl-pyran-3-ylidene)methyl]amino]benzoic acid undecyl ester Formula: C25H33NO5 MolecularWeight: 427.53322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)C=C(OC2=O)C

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)N/C=C/2\C(=O)C=C(OC2=O)C

InChI

InChI=1S/C25H33NO5/c1-3-4-5-6-7-8-9-10-11-16-30-24(28)20-12-14-21(15-13-20)26-18-22-23(27)17-19(2)31-25(22)29/h12-15,17-18,26H,3-11,16H2,1-2H3/b22-18+