(2S)-2-azanyl-5-oxidanylidene-5-[4-(3-phenoxypropanoyl)piperazin-1-yl]pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-oxidanylidene-5-[4-(3-phenoxypropanoyl)piperazin-1-yl]pentanoic acid Openeye Name: (2S)-2-amino-5-oxo-5-[4-(3-phenoxypropanoyl)piperazin-1-yl]pentanoic acid CAS Name: (2S)-2-amino-5-oxo-5-[4-(1-oxo-3-phenoxypropyl)-1-piperazinyl]pentanoic acid IUPAC Name: (2S)-2-amino-5-oxo-5-[4-(3-phenoxypropanoyl)piperazin-1-yl]pentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[4-(3-phenoxypropanoyl)piperazino]valeric acid Formula: C18H25N3O5 MolecularWeight: 363.4082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(C(=O)O)N)C(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CC[C@@H](C(=O)O)N)C(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O5/c19-15(18(24)25)6-7-16(22)20-9-11-21(12-10-20)17(23)8-13-26-14-4-2-1-3-5-14/h1-5,15H,6-13,19H2,(H,24,25)/t15-/m0/s1