1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(4-methoxyquinolin-2-yl)carbonylpyrrolidin-3-yl]piperidine-2-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(4-methoxyquinolin-2-yl)carbonylpyrrolidin-3-yl]piperidine-2-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(4-methoxyquinoline-2-carbonyl)pyrrolidin-3-yl]piperidine-2-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-[(4-methoxy-2-quinolinyl)-oxomethyl]-3-pyrrolidinyl]-2-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(4-methoxyquinoline-2-carbonyl)pyrrolidin-3-yl]piperidine-2-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(4-methoxyquinoline-2-carbonyl)pyrrolidin-3-yl]pipecolinamide Formula: C28H29N5O4 MolecularWeight: 499.56096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(C3)NC(=O)C4CCCCN4C5=NC6=CC=CC=C6O5

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CC[C@@H](C3)NC(=O)C4CCCCN4C5=NC6=CC=CC=C6O5

InChI

InChI=1S/C28H29N5O4/c1-36-25-16-22(30-20-9-3-2-8-19(20)25)27(35)32-15-13-18(17-32)29-26(34)23-11-6-7-14-33(23)28-31-21-10-4-5-12-24(21)37-28/h2-5,8-10,12,16,18,23H,6-7,11,13-15,17H2,1H3,(H,29,34)/t18-,23?/m0/s1