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

Systemtic Name: methyl 4-[(3-methylphenyl)-propyl-amino]but-2-ynoate Openeye Name: methyl 4-(3-methyl-N-propyl-anilino)but-2-ynoate CAS Name: 4-(3-methyl-N-propylanilino)-2-butynoic acid methyl ester IUPAC Name: methyl 4-(3-methyl-N-propylanilino)but-2-ynoate Traditional Name: 4-(3-methyl-N-propyl-anilino)but-2-ynoic acid methyl ester Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2/c1-4-10-16(11-6-9-15(17)18-3)14-8-5-7-13(2)12-14/h5,7-8,12H,4,10-11H2,1-3H3