tert-butyl 4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]but-2-ynoate

Systemtic Name: tert-butyl 4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]but-2-ynoate Openeye Name: tert-butyl 4-[(2-benzyloxy-2-oxo-ethyl)amino]but-2-ynoate CAS Name: 4-[(2-oxo-2-phenylmethoxyethyl)amino]-2-butynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-oxo-2-phenylmethoxyethyl)amino]but-2-ynoate Traditional Name: 4-[(2-benzoxy-2-keto-ethyl)amino]but-2-ynoic acid tert-butyl ester Formula: C17H21NO4 MolecularWeight: 303.35294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C#CCNCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)C#CCNCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H21NO4/c1-17(2,3)22-15(19)10-7-11-18-12-16(20)21-13-14-8-5-4-6-9-14/h4-6,8-9,18H,11-13H2,1-3H3