ethyl (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-4-oxidanyl-5-[(phenylmethyl)amino]pent-2-enoate

Systemtic Name: ethyl (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-4-oxidanyl-5-[(phenylmethyl)amino]pent-2-enoate Openeye Name: ethyl (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-6-benzyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-5-(benzylamino)-4-hydroxy-pent-2-enoate CAS Name: (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-4-hydroxy-5-[(phenylmethyl)amino]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-5-(benzylamino)-4-hydroxypent-2-enoate Traditional Name: (Z,4S,5S)-5-[(3aR,5R,6S,6aR)-6-benzoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-5-(benzylamino)-4-hydroxy-pent-2-enoic acid ethyl ester Formula: C28H35NO7 MolecularWeight: 497.58

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C(C1C(C2C(O1)OC(O2)(C)C)OCC3=CC=CC=C3)NCC4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)/C=C\[C@@H]([C@@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OCC3=CC=CC=C3)NCC4=CC=CC=C4)O

InChI

InChI=1S/C28H35NO7/c1-4-32-22(31)16-15-21(30)23(29-17-19-11-7-5-8-12-19)24-25(33-18-20-13-9-6-10-14-20)26-27(34-24)36-28(2,3)35-26/h5-16,21,23-27,29-30H,4,17-18H2,1-3H3/b16-15-/t21-,23-,24+,25-,26+,27+/m0/s1