ethyl (Z)-3-[[1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-oxidanylidene-propyl]amino]but-2-enoate

Systemtic Name: ethyl (Z)-3-[[1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-oxidanylidene-propyl]amino]but-2-enoate Openeye Name: ethyl (Z)-3-[[1-[(3aR,5R,6S,6aR)-6-benzyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-oxo-propyl]amino]but-2-enoate CAS Name: (Z)-3-[[1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-oxopropyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[[1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-oxopropyl]amino]but-2-enoate Traditional Name: (Z)-3-[[1-[(3aR,5R,6S,6aR)-6-benzoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-ethoxy-3-keto-propyl]amino]but-2-enoic acid ethyl ester Formula: C25H35NO8 MolecularWeight: 477.5473

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1C(C2C(O1)OC(O2)(C)C)OCC3=CC=CC=C3)NC(=CC(=O)OCC)C

Isomeric SMILES

CCOC(=O)CC([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OCC3=CC=CC=C3)N/C(=C\C(=O)OCC)/C

InChI

InChI=1S/C25H35NO8/c1-6-29-19(27)13-16(3)26-18(14-20(28)30-7-2)21-22(31-15-17-11-9-8-10-12-17)23-24(32-21)34-25(4,5)33-23/h8-13,18,21-24,26H,6-7,14-15H2,1-5H3/b16-13-/t18?,21-,22+,23-,24-/m1/s1