2-[(4-fluorophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(4-fluorophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(4-fluorophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(4-fluoroanilino)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(4-fluorophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(4-fluorophenyl)carbamoylamino]-3-(1H-indol-3-yl)propionic acid Formula: C18H16FN3O3 MolecularWeight: 341.336343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN3O3/c19-12-5-7-13(8-6-12)21-18(25)22-16(17(23)24)9-11-10-20-15-4-2-1-3-14(11)15/h1-8,10,16,20H,9H2,(H,23,24)(H2,21,22,25)