3-(hept-5-ynoylamino)-2-methyl-benzoic acid

Systemtic Name: 3-(hept-5-ynoylamino)-2-methyl-benzoic acid Openeye Name: 3-(hept-5-ynoylamino)-2-methyl-benzoic acid CAS Name: 2-methyl-3-(1-oxohept-5-ynylamino)benzoic acid IUPAC Name: 3-(hept-5-ynoylamino)-2-methylbenzoic acid Traditional Name: 3-(hept-5-ynoylamino)-2-methyl-benzoic acid Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCCC(=O)NC1=CC=CC(=C1C)C(=O)O

Isomeric SMILES

CC#CCCCC(=O)NC1=CC=CC(=C1C)C(=O)O

InChI

InChI=1S/C15H17NO3/c1-3-4-5-6-10-14(17)16-13-9-7-8-12(11(13)2)15(18)19/h7-9H,5-6,10H2,1-2H3,(H,16,17)(H,18,19)