methyl 2-(3-acetamido-4-pent-1-ynyl-phenyl)ethanoate

Systemtic Name: methyl 2-(3-acetamido-4-pent-1-ynyl-phenyl)ethanoate Openeye Name: methyl 2-(3-acetamido-4-pent-1-ynyl-phenyl)acetate CAS Name: 2-(3-acetamido-4-pent-1-ynylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-acetamido-4-pent-1-ynylphenyl)acetate Traditional Name: 2-(3-acetamido-4-pent-1-ynyl-phenyl)acetic acid methyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=C(C=C(C=C1)CC(=O)OC)NC(=O)C

Isomeric SMILES

CCCC#CC1=C(C=C(C=C1)CC(=O)OC)NC(=O)C

InChI

InChI=1S/C16H19NO3/c1-4-5-6-7-14-9-8-13(11-16(19)20-3)10-15(14)17-12(2)18/h8-10H,4-5,11H2,1-3H3,(H,17,18)