1-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]proline Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNC(=O)C(CC2=CNC3=CC=CC=C32)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CNC(=O)C(CC2=CNC3=CC=CC=C32)N)C(=O)O

InChI

InChI=1S/C18H22N4O4/c19-13(8-11-9-20-14-5-2-1-4-12(11)14)17(24)21-10-16(23)22-7-3-6-15(22)18(25)26/h1-2,4-5,9,13,15,20H,3,6-8,10,19H2,(H,21,24)(H,25,26)