methyl 2-(7-benzamido-8-oxidanylidene-non-4-ynoxy)-2-methyl-propanoate

Systemtic Name: methyl 2-(7-benzamido-8-oxidanylidene-non-4-ynoxy)-2-methyl-propanoate Openeye Name: methyl 2-(7-benzamido-8-oxo-non-4-ynoxy)-2-methyl-propanoate CAS Name: 2-(7-benzamido-8-oxonon-4-ynoxy)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-(7-benzamido-8-oxonon-4-ynoxy)-2-methylpropanoate Traditional Name: 2-(7-benzamido-8-keto-non-4-ynoxy)-2-methyl-propionic acid methyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC#CCCCOC(C)(C)C(=O)OC)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(=O)C(CC#CCCCOC(C)(C)C(=O)OC)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C21H27NO5/c1-16(23)18(22-19(24)17-12-8-7-9-13-17)14-10-5-6-11-15-27-21(2,3)20(25)26-4/h7-9,12-13,18H,6,11,14-15H2,1-4H3,(H,22,24)