4-(3-azanyl-1-oxidanylidene-isoquinolin-2-yl)-N-(4-ethoxyphenyl)benzamide

Systemtic Name: 4-(3-azanyl-1-oxidanylidene-isoquinolin-2-yl)-N-(4-ethoxyphenyl)benzamide Openeye Name: 4-(3-amino-1-oxo-2-isoquinolyl)-N-(4-ethoxyphenyl)benzamide CAS Name: 4-(3-amino-1-oxo-2-isoquinolinyl)-N-(4-ethoxyphenyl)benzamide IUPAC Name: 4-(3-amino-1-oxoisoquinolin-2-yl)-N-(4-ethoxyphenyl)benzamide Traditional Name: 4-(3-amino-1-keto-2-isoquinolyl)-N-p-phenetyl-benzamide Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC4=CC=CC=C4C3=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC4=CC=CC=C4C3=O)N

InChI

InChI=1S/C24H21N3O3/c1-2-30-20-13-9-18(10-14-20)26-23(28)16-7-11-19(12-8-16)27-22(25)15-17-5-3-4-6-21(17)24(27)29/h3-15H,2,25H2,1H3,(H,26,28)