(phenylmethyl) 3-[(2R)-2-(phenylmethoxycarbonylamino)-2-prop-2-enoxycarbonyl-pentyl]indole-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[(2R)-2-(phenylmethoxycarbonylamino)-2-prop-2-enoxycarbonyl-pentyl]indole-1-carboxylate Openeye Name: benzyl 3-[(2R)-2-allyloxycarbonyl-2-(benzyloxycarbonylamino)pentyl]indole-1-carboxylate CAS Name: 3-[(2R)-2-[oxo(prop-2-enoxy)methyl]-2-(phenylmethoxycarbonylamino)pentyl]-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2R)-2-(phenylmethoxycarbonylamino)-2-prop-2-enoxycarbonylpentyl]indole-1-carboxylate Traditional Name: 3-[(2R)-2-allyloxycarbonyl-2-(benzyloxycarbonylamino)pentyl]indole-1-carboxylic acid benzyl ester Formula: C33H34N2O6 MolecularWeight: 554.63286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CN(C2=CC=CC=C21)C(=O)OCC3=CC=CC=C3)(C(=O)OCC=C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC[C@@](CC1=CN(C2=CC=CC=C21)C(=O)OCC3=CC=CC=C3)(C(=O)OCC=C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H34N2O6/c1-3-19-33(30(36)39-20-4-2,34-31(37)40-23-25-13-7-5-8-14-25)21-27-22-35(29-18-12-11-17-28(27)29)32(38)41-24-26-15-9-6-10-16-26/h4-18,22H,2-3,19-21,23-24H2,1H3,(H,34,37)/t33-/m1/s1