methyl 5-[(phenylmethyl)amino]pent-2-ynoate

Systemtic Name: methyl 5-[(phenylmethyl)amino]pent-2-ynoate Openeye Name: methyl 5-(benzylamino)pent-2-ynoate CAS Name: 5-[(phenylmethyl)amino]-2-pentynoic acid methyl ester IUPAC Name: methyl 5-(benzylamino)pent-2-ynoate Traditional Name: 5-(benzylamino)pent-2-ynoic acid methyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCCNCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C#CCCNCC1=CC=CC=C1

InChI

InChI=1S/C13H15NO2/c1-16-13(15)9-5-6-10-14-11-12-7-3-2-4-8-12/h2-4,7-8,14H,6,10-11H2,1H3