1-(1,3-benzoxazol-2-yl)-2-pyrrolidin-3-yl-3-quinolin-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-2-pyrrolidin-3-yl-3-quinolin-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-2-pyrrolidin-3-yl-3-(quinoline-2-carbonyl)piperidine-2-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-3-[oxo(2-quinolinyl)methyl]-2-(3-pyrrolidinyl)-2-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-2-pyrrolidin-3-yl-3-(quinoline-2-carbonyl)piperidine-2-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-2-pyrrolidin-3-yl-3-quinaldoyl-pipecolinamide Formula: C27H27N5O3 MolecularWeight: 469.53498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C2=NC3=CC=CC=C3O2)(C4CCNC4)C(=O)N)C(=O)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1CC(C(N(C1)C2=NC3=CC=CC=C3O2)(C4CCNC4)C(=O)N)C(=O)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C27H27N5O3/c28-25(34)27(18-13-14-29-16-18)19(24(33)22-12-11-17-6-1-2-8-20(17)30-22)7-5-15-32(27)26-31-21-9-3-4-10-23(21)35-26/h1-4,6,8-12,18-19,29H,5,7,13-16H2,(H2,28,34)