ethyl (3S)-3-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl (3S)-3-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl (3S)-3-[(3aR,5R,6S,6aR)-6-benzyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[benzyl(benzyloxycarbonyl)amino]propanoate CAS Name: (3S)-3-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[phenylmethoxycarbonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[benzyl(phenylmethoxycarbonyl)amino]propanoate Traditional Name: (3S)-3-[(3aR,5R,6S,6aR)-6-benzoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-[benzyl(carbobenzoxy)amino]propionic acid ethyl ester Formula: C34H39NO8 MolecularWeight: 589.67536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1C(C2C(O1)OC(O2)(C)C)OCC3=CC=CC=C3)N(CC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C[C@@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OCC3=CC=CC=C3)N(CC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C34H39NO8/c1-4-38-28(36)20-27(35(21-24-14-8-5-9-15-24)33(37)40-23-26-18-12-7-13-19-26)29-30(39-22-25-16-10-6-11-17-25)31-32(41-29)43-34(2,3)42-31/h5-19,27,29-32H,4,20-23H2,1-3H3/t27-,29+,30-,31+,32+/m0/s1