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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CC3=CC=CC=C3C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CC3=CC=CC=C3C=C2)C(=O)O)C(=O)O

InChI

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