3-[[4-[1-methyl-4-(1-methylpiperidin-4-yl)imidazol-2-yl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-methyl-4-(1-methylpiperidin-4-yl)imidazol-2-yl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-methyl-4-(1-methyl-4-piperidyl)imidazol-2-yl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[1-methyl-4-(1-methyl-4-piperidinyl)-2-imidazolyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-methyl-4-(1-methylpiperidin-4-yl)imidazol-2-yl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-methyl-4-(1-methyl-4-piperidyl)imidazol-2-yl]benzoyl]amino]propionic acid Formula: C20H26N4O3 MolecularWeight: 370.44544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=CN(C(=N2)C3=CC=C(C=C3)C(=O)NCCC(=O)O)C

Isomeric SMILES

CN1CCC(CC1)C2=CN(C(=N2)C3=CC=C(C=C3)C(=O)NCCC(=O)O)C

InChI

InChI=1S/C20H26N4O3/c1-23-11-8-14(9-12-23)17-13-24(2)19(22-17)15-3-5-16(6-4-15)20(27)21-10-7-18(25)26/h3-6,13-14H,7-12H2,1-2H3,(H,21,27)(H,25,26)