methyl 4-[butyl-(3-methylphenyl)amino]but-2-ynoate

Systemtic Name: methyl 4-[butyl-(3-methylphenyl)amino]but-2-ynoate Openeye Name: methyl 4-(N-butyl-3-methyl-anilino)but-2-ynoate CAS Name: 4-(N-butyl-3-methylanilino)-2-butynoic acid methyl ester IUPAC Name: methyl 4-(N-butyl-3-methylanilino)but-2-ynoate Traditional Name: 4-(N-butyl-3-methyl-anilino)but-2-ynoic acid methyl ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC#CC(=O)OC)C1=CC=CC(=C1)C

Isomeric SMILES

CCCCN(CC#CC(=O)OC)C1=CC=CC(=C1)C

InChI

InChI=1S/C16H21NO2/c1-4-5-11-17(12-7-10-16(18)19-3)15-9-6-8-14(2)13-15/h6,8-9,13H,4-5,11-12H2,1-3H3