ethyl 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-oxidanylidene-pent-1-ynyl)phenyl]pent-4-ynoate

Systemtic Name: ethyl 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-oxidanylidene-pent-1-ynyl)phenyl]pent-4-ynoate Openeye Name: ethyl 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-oxo-pent-1-ynyl)phenyl]pent-4-ynoate CAS Name: 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-oxopent-1-ynyl)phenyl]-4-pentynoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-oxopent-1-ynyl)phenyl]pent-4-ynoate Traditional Name: 2-acetamido-5-[4-(4-acetamido-5-ethoxy-5-keto-pent-1-ynyl)phenyl]pent-4-ynoic acid ethyl ester Formula: C24H28N2O6 MolecularWeight: 440.48892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#CC1=CC=C(C=C1)C#CCC(C(=O)OCC)NC(=O)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC#CC1=CC=C(C=C1)C#CCC(C(=O)OCC)NC(=O)C)NC(=O)C

InChI

InChI=1S/C24H28N2O6/c1-5-31-23(29)21(25-17(3)27)11-7-9-19-13-15-20(16-14-19)10-8-12-22(26-18(4)28)24(30)32-6-2/h13-16,21-22H,5-6,11-12H2,1-4H3,(H,25,27)(H,26,28)