ethyl (E)-5-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethyl)hex-2-enoate

Systemtic Name: ethyl (E)-5-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethyl)hex-2-enoate Openeye Name: ethyl (E)-2-benzyl-5-(tert-butoxycarbonylamino)-5-methyl-hex-2-enoate CAS Name: (E)-5-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethyl)-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-2-benzyl-5-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-2-enoate Traditional Name: (E)-2-benzyl-5-(tert-butoxycarbonylamino)-5-methyl-hex-2-enoic acid ethyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCC(C)(C)NC(=O)OC(C)(C)C)CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C(=C/CC(C)(C)NC(=O)OC(C)(C)C)/CC1=CC=CC=C1

InChI

InChI=1S/C21H31NO4/c1-7-25-18(23)17(15-16-11-9-8-10-12-16)13-14-21(5,6)22-19(24)26-20(2,3)4/h8-13H,7,14-15H2,1-6H3,(H,22,24)/b17-13+