N-(5-acetamido-2-methoxy-phenyl)-2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[C@@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C22H23N3O4/c1-14(26)23-17-8-9-21(29-3)19(12-17)24-22(28)13-20-18-7-5-4-6-16(18)10-11-25(20)15(2)27/h4-12,20H,13H2,1-3H3,(H,23,26)(H,24,28)/t20-/m1/s1