4-acetamido-5-chloranyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxy-benzamide

Systemtic Name: 4-acetamido-5-chloranyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxy-benzamide Openeye Name: 4-acetamido-5-chloro-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxy-benzamide CAS Name: 4-acetamido-5-chloro-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxybenzamide IUPAC Name: 4-acetamido-5-chloro-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxybenzamide Traditional Name: 4-acetamido-5-chloro-N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)-2-propoxy-benzamide Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1C(=O)NC2=CC=CC3=C2CCN(C3)C)Cl)NC(=O)C

Isomeric SMILES

CCCOC1=CC(=C(C=C1C(=O)NC2=CC=CC3=C2CCN(C3)C)Cl)NC(=O)C

InChI

InChI=1S/C22H26ClN3O3/c1-4-10-29-21-12-20(24-14(2)27)18(23)11-17(21)22(28)25-19-7-5-6-15-13-26(3)9-8-16(15)19/h5-7,11-12H,4,8-10,13H2,1-3H3,(H,24,27)(H,25,28)