2-[[2-[(1-methylindol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[2-[(1-methylindol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[2-[(1-methylindole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[2-[[(1-methyl-2-indolyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[2-[(1-methylindole-2-carbonyl)amino]-3-phenylpropanoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[2-[(1-methylindole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]propionic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CO)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C22H23N3O5/c1-25-18-10-6-5-9-15(18)12-19(25)21(28)23-16(11-14-7-3-2-4-8-14)20(27)24-17(13-26)22(29)30/h2-10,12,16-17,26H,11,13H2,1H3,(H,23,28)(H,24,27)(H,29,30)