ethyl (E,4S)-4-[[(2S)-3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-2,5-dimethyl-hex-2-enoate

Systemtic Name: ethyl (E,4S)-4-[[(2S)-3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-2,5-dimethyl-hex-2-enoate Openeye Name: ethyl (E,4S)-4-[[(2S)-2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-2,5-dimethyl-hex-2-enoate CAS Name: (E,4S)-4-[[(2S)-3,3-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]-2,5-dimethyl-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[[(2S)-3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-2,5-dimethylhex-2-enoate Traditional Name: (E,4S)-4-[[(2S)-2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-2,5-dimethyl-hex-2-enoic acid ethyl ester Formula: C21H38N2O5 MolecularWeight: 398.53682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C(=C/[C@H](C(C)C)NC(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C)/C

InChI

InChI=1S/C21H38N2O5/c1-11-27-18(25)14(4)12-15(13(2)3)22-17(24)16(20(5,6)7)23-19(26)28-21(8,9)10/h12-13,15-16H,11H2,1-10H3,(H,22,24)(H,23,26)/b14-12+/t15-,16-/m1/s1