(2S)-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-[4-(1-naphthyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-5-[4-(1-naphthalenyl)-1-piperazinyl]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-keto-5-[4-(1-naphthyl)piperazino]valeric acid Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CCC(C(=O)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CC[C@@H](C(=O)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O5/c31-25(14-13-23(26(32)33)28-27(34)35-19-20-7-2-1-3-8-20)30-17-15-29(16-18-30)24-12-6-10-21-9-4-5-11-22(21)24/h1-12,23H,13-19H2,(H,28,34)(H,32,33)/t23-/m0/s1