(2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-yl-ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-yl-ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-2-(1-naphthyl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(1-naphthalenyl)-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-ylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-2-(1-naphthyl)acetyl]proline Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC2=CC=CC=C21)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C1=CC=CC2=CC=CC=C21)C(=O)N3CCC[C@H]3C(=O)O

InChI

InChI=1S/C22H26N2O5/c1-22(2,3)29-21(28)23-18(19(25)24-13-7-12-17(24)20(26)27)16-11-6-9-14-8-4-5-10-15(14)16/h4-6,8-11,17-18H,7,12-13H2,1-3H3,(H,23,28)(H,26,27)/t17-,18-/m0/s1