ethyl 3-(2,3-diphenyl-1H-isoquinolin-1-yl)prop-2-ynoate

Systemtic Name: ethyl 3-(2,3-diphenyl-1H-isoquinolin-1-yl)prop-2-ynoate Openeye Name: ethyl 3-(2,3-diphenyl-1H-isoquinolin-1-yl)prop-2-ynoate CAS Name: 3-(2,3-diphenyl-1H-isoquinolin-1-yl)-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-(2,3-diphenyl-1H-isoquinolin-1-yl)prop-2-ynoate Traditional Name: 3-(2,3-diphenyl-1H-isoquinolin-1-yl)propiolic acid ethyl ester Formula: C26H21NO2 MolecularWeight: 379.45044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C#CC1C2=CC=CC=C2C=C(N1C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO2/c1-2-29-26(28)18-17-24-23-16-10-9-13-21(23)19-25(20-11-5-3-6-12-20)27(24)22-14-7-4-8-15-22/h3-16,19,24H,2H2,1H3