(2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2-(phenylmethyl)-1,4-diazaspiro[4.6]undecan-3-one

Systemtic Name: (2S)-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-2-(phenylmethyl)-1,4-diazaspiro[4.6]undecan-3-one Openeye Name: (2S)-2-benzyl-4-[4-[(6-methoxy-8-quinolyl)amino]pentyl]-1,4-diazaspiro[4.6]undecan-3-one CAS Name: (2S)-4-[4-[(6-methoxy-8-quinolinyl)amino]pentyl]-2-(phenylmethyl)-1,4-diazaspiro[4.6]undecan-3-one IUPAC Name: (2S)-2-benzyl-4-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-1,4-diazaspiro[4.6]undecan-3-one Traditional Name: (2S)-2-benzyl-4-[4-[(6-methoxy-8-quinolyl)amino]pentyl]-1,4-diazaspiro[4.6]undecan-3-one Formula: C31H40N4O2 MolecularWeight: 500.6749

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1C(=O)C(NC12CCCCCC2)CC3=CC=CC=C3)NC4=C5C(=CC(=C4)OC)C=CC=N5

Isomeric SMILES

CC(CCCN1C(=O)[C@@H](NC12CCCCCC2)CC3=CC=CC=C3)NC4=C5C(=CC(=C4)OC)C=CC=N5

InChI

InChI=1S/C31H40N4O2/c1-23(33-27-22-26(37-2)21-25-15-10-18-32-29(25)27)12-11-19-35-30(36)28(20-24-13-6-5-7-14-24)34-31(35)16-8-3-4-9-17-31/h5-7,10,13-15,18,21-23,28,33-34H,3-4,8-9,11-12,16-17,19-20H2,1-2H3/t23?,28-/m0/s1