methyl 2-[3-(pent-4-ynoylamino)phenyl]ethanoate

Systemtic Name: methyl 2-[3-(pent-4-ynoylamino)phenyl]ethanoate Openeye Name: methyl 2-[3-(pent-4-ynoylamino)phenyl]acetate CAS Name: 2-[3-(1-oxopent-4-ynylamino)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(pent-4-ynoylamino)phenyl]acetate Traditional Name: 2-[3-(pent-4-ynoylamino)phenyl]acetic acid methyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)NC(=O)CCC#C

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)NC(=O)CCC#C

InChI

InChI=1S/C14H15NO3/c1-3-4-8-13(16)15-12-7-5-6-11(9-12)10-14(17)18-2/h1,5-7,9H,4,8,10H2,2H3,(H,15,16)