ethyl 3-(azetidin-1-yl)-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: ethyl 3-(azetidin-1-yl)-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: ethyl 3-(azetidin-1-yl)-2-[[4-[(2-methyl-4-quinolyl)methoxy]benzoyl]amino]cyclohexanecarboxylate CAS Name: 3-(1-azetidinyl)-2-[[[4-[(2-methyl-4-quinolinyl)methoxy]phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(azetidin-1-yl)-2-[[4-[(2-methylquinolin-4-yl)methoxy]benzoyl]amino]cyclohexane-1-carboxylate Traditional Name: 3-(azetidin-1-yl)-2-[[4-[(2-methyl-4-quinolyl)methoxy]benzoyl]amino]cyclohexanecarboxylic acid ethyl ester Formula: C30H35N3O4 MolecularWeight: 501.6166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1NC(=O)C2=CC=C(C=C2)OCC3=CC(=NC4=CC=CC=C43)C)N5CCC5

Isomeric SMILES

CCOC(=O)C1CCCC(C1NC(=O)C2=CC=C(C=C2)OCC3=CC(=NC4=CC=CC=C43)C)N5CCC5

InChI

InChI=1S/C30H35N3O4/c1-3-36-30(35)25-9-6-11-27(33-16-7-17-33)28(25)32-29(34)21-12-14-23(15-13-21)37-19-22-18-20(2)31-26-10-5-4-8-24(22)26/h4-5,8,10,12-15,18,25,27-28H,3,6-7,9,11,16-17,19H2,1-2H3,(H,32,34)