ethyl 4-[(4-methoxyphenyl)amino]but-2-ynoate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)amino]but-2-ynoate Openeye Name: ethyl 4-(4-methoxyanilino)but-2-ynoate CAS Name: 4-(4-methoxyanilino)-2-butynoic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyanilino)but-2-ynoate Traditional Name: 4-(p-anisidino)but-2-ynoic acid ethyl ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CCNC1=CC=C(C=C1)OC

Isomeric SMILES

CCOC(=O)C#CCNC1=CC=C(C=C1)OC

InChI

InChI=1S/C13H15NO3/c1-3-17-13(15)5-4-10-14-11-6-8-12(16-2)9-7-11/h6-9,14H,3,10H2,1-2H3