methyl 3-(3-cyanophenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate

Systemtic Name: methyl 3-(3-cyanophenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Openeye Name: methyl 3-(3-cyanophenyl)-2-[3-(6-isopropyl-8-quinolyl)phenyl]propanoate CAS Name: 3-(3-cyanophenyl)-2-[3-(6-propan-2-yl-8-quinolinyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-(3-cyanophenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Traditional Name: 3-(3-cyanophenyl)-2-[3-(6-isopropyl-8-quinolyl)phenyl]propionic acid methyl ester Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(CC4=CC=CC(=C4)C#N)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(CC4=CC=CC(=C4)C#N)C(=O)OC

InChI

InChI=1S/C29H26N2O2/c1-19(2)25-16-24-11-6-12-31-28(24)26(17-25)22-9-5-10-23(15-22)27(29(32)33-3)14-20-7-4-8-21(13-20)18-30/h4-13,15-17,19,27H,14H2,1-3H3