1-[2-(2-azanylethanoylamino)-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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