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

Systemtic Name: (2S)-2-azanyl-5-[4-(2-methylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[4-(o-tolyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[4-(2-methylphenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[4-(2-methylphenyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-[4-(o-tolyl)piperazino]valeric acid Formula: C16H23N3O3 MolecularWeight: 305.37212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)CCC(C(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C16H23N3O3/c1-12-4-2-3-5-14(12)18-8-10-19(11-9-18)15(20)7-6-13(17)16(21)22/h2-5,13H,6-11,17H2,1H3,(H,21,22)/t13-/m0/s1