ethyl 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]hex-5-ynoate

Systemtic Name: ethyl 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]hex-5-ynoate Openeye Name: ethyl 3-[4-(tert-butoxycarbonylamino)phenyl]hex-5-ynoate CAS Name: 3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-5-hexynoic acid ethyl ester IUPAC Name: ethyl 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]hex-5-ynoate Traditional Name: 3-[4-(tert-butoxycarbonylamino)phenyl]hex-5-ynoic acid ethyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC#C)C1=CC=C(C=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC(CC#C)C1=CC=C(C=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H25NO4/c1-6-8-15(13-17(21)23-7-2)14-9-11-16(12-10-14)20-18(22)24-19(3,4)5/h1,9-12,15H,7-8,13H2,2-5H3,(H,20,22)