[1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl-ethanoyl-amino] ethanoate

Systemtic Name: [1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl-ethanoyl-amino] ethanoate Openeye Name: [acetyl-[1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl]amino] acetate CAS Name: acetic acid [acetyl-[1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl]amino] ester IUPAC Name: [acetyl-[1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl]amino] acetate Traditional Name: acetic acid [acetyl-[1-[3-[2-(4-chlorophenyl)ethynyl]phenyl]ethyl]amino] ester Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C#CC2=CC=C(C=C2)Cl)N(C(=O)C)OC(=O)C

Isomeric SMILES

CC(C1=CC=CC(=C1)C#CC2=CC=C(C=C2)Cl)N(C(=O)C)OC(=O)C

InChI

InChI=1S/C20H18ClNO3/c1-14(22(15(2)23)25-16(3)24)19-6-4-5-18(13-19)8-7-17-9-11-20(21)12-10-17/h4-6,9-14H,1-3H3