(2R)-3-cyclobutyl-2-[(3S,4S)-3-[(4-imidazo[1,2-b]pyridazin-3-ylpiperidin-1-yl)methyl]-4-phenyl-pyrrolidin-1-yl]propanoic acid

Systemtic Name: (2R)-3-cyclobutyl-2-[(3S,4S)-3-[(4-imidazo[1,2-b]pyridazin-3-ylpiperidin-1-yl)methyl]-4-phenyl-pyrrolidin-1-yl]propanoic acid Openeye Name: (2R)-3-cyclobutyl-2-[(3S,4S)-3-[(4-imidazo[1,2-b]pyridazin-3-yl-1-piperidyl)methyl]-4-phenyl-pyrrolidin-1-yl]propanoic acid CAS Name: (2R)-3-cyclobutyl-2-[(3S,4S)-3-[[4-(3-imidazo[1,2-b]pyridazinyl)-1-piperidinyl]methyl]-4-phenyl-1-pyrrolidinyl]propanoic acid IUPAC Name: (2R)-3-cyclobutyl-2-[(3S,4S)-3-[(4-imidazo[1,2-b]pyridazin-3-ylpiperidin-1-yl)methyl]-4-phenylpyrrolidin-1-yl]propanoic acid Traditional Name: (2R)-3-cyclobutyl-2-[(3S,4S)-3-[(4-imidazo[1,2-b]pyridazin-3-ylpiperidino)methyl]-4-phenyl-pyrrolidino]propionic acid Formula: C29H37N5O2 MolecularWeight: 487.63638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CC(C(=O)O)N2CC(C(C2)C3=CC=CC=C3)CN4CCC(CC4)C5=CN=C6N5N=CC=C6

Isomeric SMILES

C1CC(C1)C[C@H](C(=O)O)N2C[C@@H]([C@H](C2)C3=CC=CC=C3)CN4CCC(CC4)C5=CN=C6N5N=CC=C6

InChI

InChI=1S/C29H37N5O2/c35-29(36)26(16-21-6-4-7-21)33-19-24(25(20-33)22-8-2-1-3-9-22)18-32-14-11-23(12-15-32)27-17-30-28-10-5-13-31-34(27)28/h1-3,5,8-10,13,17,21,23-26H,4,6-7,11-12,14-16,18-20H2,(H,35,36)/t24-,25+,26+/m0/s1