(phenylmethyl) 3-[(2S)-2-(methoxymethyl)-3-oxidanylidene-2-(phenylmethoxycarbonylamino)-3-prop-2-enoxy-propyl]indole-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[(2S)-2-(methoxymethyl)-3-oxidanylidene-2-(phenylmethoxycarbonylamino)-3-prop-2-enoxy-propyl]indole-1-carboxylate Openeye Name: benzyl 3-[(2S)-3-allyloxy-2-(benzyloxycarbonylamino)-2-(methoxymethyl)-3-oxo-propyl]indole-1-carboxylate CAS Name: 3-[(2S)-2-(methoxymethyl)-3-oxo-2-(phenylmethoxycarbonylamino)-3-prop-2-enoxypropyl]-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2S)-2-(methoxymethyl)-3-oxo-2-(phenylmethoxycarbonylamino)-3-prop-2-enoxypropyl]indole-1-carboxylate Traditional Name: 3-[(2S)-3-allyloxy-2-(benzyloxycarbonylamino)-3-keto-2-(methoxymethyl)propyl]indole-1-carboxylic acid benzyl ester Formula: C32H32N2O7 MolecularWeight: 556.60568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC[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/C32H32N2O7/c1-3-18-39-29(35)32(23-38-2,33-30(36)40-21-24-12-6-4-7-13-24)19-26-20-34(28-17-11-10-16-27(26)28)31(37)41-22-25-14-8-5-9-15-25/h3-17,20H,1,18-19,21-23H2,2H3,(H,33,36)/t32-/m0/s1