(2R)-6-azanyl-2-[2-[carboxymethyl(2-naphthalen-2-ylethanoyl)amino]ethanoylamino]hexanoic acid

Systemtic Name: (2R)-6-azanyl-2-[2-[carboxymethyl(2-naphthalen-2-ylethanoyl)amino]ethanoylamino]hexanoic acid Openeye Name: (2R)-6-amino-2-[[2-[carboxymethyl-[2-(2-naphthyl)acetyl]amino]acetyl]amino]hexanoic acid CAS Name: (2R)-6-amino-2-[[2-[carboxymethyl-[2-(2-naphthalenyl)-1-oxoethyl]amino]-1-oxoethyl]amino]hexanoic acid IUPAC Name: (2R)-6-amino-2-[[2-[carboxymethyl-(2-naphthalen-2-ylacetyl)amino]acetyl]amino]hexanoic acid Traditional Name: (2R)-6-amino-2-[[2-[carboxymethyl-[2-(2-naphthyl)acetyl]amino]acetyl]amino]hexanoic acid Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(=O)N(CC(=O)NC(CCCCN)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC(=O)N(CC(=O)N[C@H](CCCCN)C(=O)O)CC(=O)O

InChI

InChI=1S/C22H27N3O6/c23-10-4-3-7-18(22(30)31)24-19(26)13-25(14-21(28)29)20(27)12-15-8-9-16-5-1-2-6-17(16)11-15/h1-2,5-6,8-9,11,18H,3-4,7,10,12-14,23H2,(H,24,26)(H,28,29)(H,30,31)/t18-/m1/s1