ethyl (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-2-prop-2-enyl-pent-2-enoate

Systemtic Name: ethyl (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-2-prop-2-enyl-pent-2-enoate Openeye Name: ethyl (E,4S)-2-allyl-4-(tert-butoxycarbonylamino)-5-phenyl-pent-2-enoate CAS Name: (E,4S)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-2-prop-2-enyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-2-prop-2-enylpent-2-enoate Traditional Name: (E,4S)-2-allyl-4-(tert-butoxycarbonylamino)-5-phenyl-pent-2-enoic acid ethyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C(=C/[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)/CC=C

InChI

InChI=1S/C21H29NO4/c1-6-11-17(19(23)25-7-2)15-18(14-16-12-9-8-10-13-16)22-20(24)26-21(3,4)5/h6,8-10,12-13,15,18H,1,7,11,14H2,2-5H3,(H,22,24)/b17-15+/t18-/m0/s1