phenacyl (2S)-1-[(2S)-2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: phenacyl (2S)-1-[(2S)-2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate Openeye Name: phenacyl (2S)-1-[(2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-[methyl-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid phenacyl ester IUPAC Name: phenacyl (2S)-1-[(2S)-2-[methyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid phenacyl ester Formula: C37H43N3O7 MolecularWeight: 641.75322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N(C)C(CC2=CC=CC=C2)C(=O)N3CCCC3C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N3CCC[C@H]3C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C37H43N3O7/c1-37(2,3)47-36(45)38-29(23-26-15-8-5-9-16-26)33(42)39(4)31(24-27-17-10-6-11-18-27)34(43)40-22-14-21-30(40)35(44)46-25-32(41)28-19-12-7-13-20-28/h5-13,15-20,29-31H,14,21-25H2,1-4H3,(H,38,45)/t29-,30-,31-/m0/s1