1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(1-quinolin-4-ylethyl)pyrrolidin-3-yl]piperidine-2-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(1-quinolin-4-ylethyl)pyrrolidin-3-yl]piperidine-2-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-[1-(4-quinolyl)ethyl]pyrrolidin-3-yl]piperidine-2-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-[1-(4-quinolinyl)ethyl]-3-pyrrolidinyl]-2-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-(1-quinolin-4-ylethyl)pyrrolidin-3-yl]piperidine-2-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[(3S)-1-[1-(4-quinolyl)ethyl]pyrrolidin-3-yl]pipecolinamide Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC2=CC=CC=C12)N3CCC(C3)NC(=O)C4CCCCN4C5=NC6=CC=CC=C6O5

Isomeric SMILES

CC(C1=CC=NC2=CC=CC=C12)N3CC[C@@H](C3)NC(=O)C4CCCCN4C5=NC6=CC=CC=C6O5

InChI

InChI=1S/C28H31N5O2/c1-19(21-13-15-29-23-9-3-2-8-22(21)23)32-17-14-20(18-32)30-27(34)25-11-6-7-16-33(25)28-31-24-10-4-5-12-26(24)35-28/h2-5,8-10,12-13,15,19-20,25H,6-7,11,14,16-18H2,1H3,(H,30,34)/t19?,20-,25?/m0/s1