methyl 3-[(5-oxidanylidene-5-prop-2-ynoxy-pentanoyl)amino]benzoate

Systemtic Name: methyl 3-[(5-oxidanylidene-5-prop-2-ynoxy-pentanoyl)amino]benzoate Openeye Name: methyl 3-[(5-oxo-5-prop-2-ynoxy-pentanoyl)amino]benzoate CAS Name: 3-[(1,5-dioxo-5-prop-2-ynoxypentyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-oxo-5-prop-2-ynoxypentanoyl)amino]benzoate Traditional Name: 3-[(5-keto-5-propargyloxy-pentanoyl)amino]benzoic acid methyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCCC(=O)OCC#C

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCCC(=O)OCC#C

InChI

InChI=1S/C16H17NO5/c1-3-10-22-15(19)9-5-8-14(18)17-13-7-4-6-12(11-13)16(20)21-2/h1,4,6-7,11H,5,8-10H2,2H3,(H,17,18)