(2S)-2-azanyl-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]-5-keto-valeric acid Formula: C17H23N3O5 MolecularWeight: 349.38162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCCO3)C(=O)CCC(C(=O)O)N

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCCO3)C(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C17H23N3O5/c18-13(17(22)23)2-4-16(21)20-7-5-19(6-8-20)12-1-3-14-15(11-12)25-10-9-24-14/h1,3,11,13H,2,4-10,18H2,(H,22,23)/t13-/m0/s1