ethyl 4-[2-[4-[(cyclopropylamino)methyl]-3-propan-2-yl-phenyl]ethynyl]benzoate

Systemtic Name: ethyl 4-[2-[4-[(cyclopropylamino)methyl]-3-propan-2-yl-phenyl]ethynyl]benzoate Openeye Name: ethyl 4-[2-[4-[(cyclopropylamino)methyl]-3-isopropyl-phenyl]ethynyl]benzoate CAS Name: 4-[2-[4-[(cyclopropylamino)methyl]-3-propan-2-ylphenyl]ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[(cyclopropylamino)methyl]-3-propan-2-ylphenyl]ethynyl]benzoate Traditional Name: 4-[2-[4-[(cyclopropylamino)methyl]-3-isopropyl-phenyl]ethynyl]benzoic acid ethyl ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC(=C(C=C2)CNC3CC3)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2=CC(=C(C=C2)CNC3CC3)C(C)C

InChI

InChI=1S/C24H27NO2/c1-4-27-24(26)20-10-7-18(8-11-20)5-6-19-9-12-21(16-25-22-13-14-22)23(15-19)17(2)3/h7-12,15,17,22,25H,4,13-14,16H2,1-3H3