1-[6-azanyl-2-[(4-naphthalen-1-yl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-azanyl-2-[(4-naphthalen-1-yl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-amino-2-[[1-carboxy-3-(1-naphthyl)propyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-amino-2-[[1-hydroxy-4-(1-naphthalenyl)-1-oxobutan-2-yl]amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-amino-2-[(1-hydroxy-4-naphthalen-1-yl-1-oxobutan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-amino-2-[[1-carboxy-3-(1-naphthyl)propyl]amino]hexanoyl]proline Formula: C25H33N3O5 MolecularWeight: 455.54662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CC=CC3=CC=CC=C32)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CC=CC3=CC=CC=C32)C(=O)O)C(=O)O

InChI

InChI=1S/C25H33N3O5/c26-15-4-3-11-20(23(29)28-16-6-12-22(28)25(32)33)27-21(24(30)31)14-13-18-9-5-8-17-7-1-2-10-19(17)18/h1-2,5,7-10,20-22,27H,3-4,6,11-16,26H2,(H,30,31)(H,32,33)