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

Systemtic Name: ethyl 5-[(phenylmethyl)amino]pent-2-ynoate Openeye Name: ethyl 5-(benzylamino)pent-2-ynoate CAS Name: 5-[(phenylmethyl)amino]-2-pentynoic acid ethyl ester IUPAC Name: ethyl 5-(benzylamino)pent-2-ynoate Traditional Name: 5-(benzylamino)pent-2-ynoic acid ethyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2/c1-2-17-14(16)10-6-7-11-15-12-13-8-4-3-5-9-13/h3-5,8-9,15H,2,7,11-12H2,1H3