4-cyclopropyl-2,2-dimethyl-4-oxidanylidene-3-[5-(quinolin-2-ylmethoxy)-1H-indol-2-yl]butanoate

Systemtic Name: 4-cyclopropyl-2,2-dimethyl-4-oxidanylidene-3-[5-(quinolin-2-ylmethoxy)-1H-indol-2-yl]butanoate Openeye Name: 4-cyclopropyl-2,2-dimethyl-4-oxo-3-[5-(2-quinolylmethoxy)-1H-indol-2-yl]butanoate CAS Name: 4-cyclopropyl-2,2-dimethyl-4-oxo-3-[5-(2-quinolinylmethoxy)-1H-indol-2-yl]butanoate IUPAC Name: 4-cyclopropyl-2,2-dimethyl-4-oxo-3-[5-(quinolin-2-ylmethoxy)-1H-indol-2-yl]butanoate Traditional Name: 4-cyclopropyl-4-keto-2,2-dimethyl-3-[5-(2-quinolylmethoxy)-1H-indol-2-yl]butyrate Formula: C27H25N2O4- MolecularWeight: 441.4984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC2=C(N1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)C5CC5)C(=O)[O-]

Isomeric SMILES

CC(C)(C(C1=CC2=C(N1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)C5CC5)C(=O)[O-]

InChI

InChI=1S/C27H26N2O4/c1-27(2,26(31)32)24(25(30)17-7-8-17)23-14-18-13-20(11-12-22(18)29-23)33-15-19-10-9-16-5-3-4-6-21(16)28-19/h3-6,9-14,17,24,29H,7-8,15H2,1-2H3,(H,31,32)/p-1