tert-butyl 3-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]-5-phenyl-indole-1-carboxylate

Systemtic Name: tert-butyl 3-[(2S)-3-methoxy-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]-5-phenyl-indole-1-carboxylate Openeye Name: tert-butyl 3-[(2S)-2-(benzyloxycarbonylamino)-3-methoxy-3-oxo-propyl]-5-phenyl-indole-1-carboxylate CAS Name: 3-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]-5-phenyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2S)-3-methoxy-3-oxo-2-(phenylmethoxycarbonylamino)propyl]-5-phenylindole-1-carboxylate Traditional Name: 3-[(2S)-2-(benzyloxycarbonylamino)-3-keto-3-methoxy-propyl]-5-phenyl-indole-1-carboxylic acid tert-butyl ester Formula: C31H32N2O6 MolecularWeight: 528.59558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)C3=CC=CC=C3)CC(C(=O)OC)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)C3=CC=CC=C3)C[C@@H](C(=O)OC)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H32N2O6/c1-31(2,3)39-30(36)33-19-24(25-17-23(15-16-27(25)33)22-13-9-6-10-14-22)18-26(28(34)37-4)32-29(35)38-20-21-11-7-5-8-12-21/h5-17,19,26H,18,20H2,1-4H3,(H,32,35)/t26-/m0/s1