N-[5,8-bis(chloranyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]-3-cyano-4-ethoxy-benzamide

Systemtic Name: N-[5,8-bis(chloranyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]-3-cyano-4-ethoxy-benzamide Openeye Name: 3-cyano-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxy-benzamide CAS Name: 3-cyano-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxybenzamide IUPAC Name: 3-cyano-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxybenzamide Traditional Name: 3-cyano-N-(5,8-dichloro-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-ethoxy-benzamide Formula: C19H17Cl2N3O2 MolecularWeight: 390.26318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2Cl)Cl)C#N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2Cl)Cl)C#N

InChI

InChI=1S/C19H17Cl2N3O2/c1-2-26-17-4-3-11(7-12(17)9-22)19(25)24-16-8-15(20)13-5-6-23-10-14(13)18(16)21/h3-4,7-8,23H,2,5-6,10H2,1H3,(H,24,25)