N-[2-(3-ethynylphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxy-benzamide

Systemtic Name: N-[2-(3-ethynylphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxy-benzamide Openeye Name: N-[2-(3-ethynylbenzoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxy-benzamide CAS Name: N-[2-[(3-ethynylphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxybenzamide IUPAC Name: N-[2-(3-ethynylbenzoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxybenzamide Traditional Name: N-[2-(3-ethynylbenzoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxy-benzamide Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC(=C4)C#C)C=C2

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC(=C4)C#C)C=C2

InChI

InChI=1S/C26H22N2O3/c1-3-18-7-6-8-20(15-18)26(30)28-14-13-19-11-12-22(16-21(19)17-28)27-25(29)23-9-4-5-10-24(23)31-2/h1,4-12,15-16H,13-14,17H2,2H3,(H,27,29)