N-[3-azanyl-2-(2-methoxyethyl)-4-(3-methylphenyl)-1-oxidanylidene-isoquinolin-7-yl]cyclobutanecarboxamide

Systemtic Name: N-[3-azanyl-2-(2-methoxyethyl)-4-(3-methylphenyl)-1-oxidanylidene-isoquinolin-7-yl]cyclobutanecarboxamide Openeye Name: N-[3-amino-2-(2-methoxyethyl)-4-(m-tolyl)-1-oxo-7-isoquinolyl]cyclobutanecarboxamide CAS Name: N-[3-amino-2-(2-methoxyethyl)-4-(3-methylphenyl)-1-oxo-7-isoquinolinyl]cyclobutanecarboxamide IUPAC Name: N-[3-amino-2-(2-methoxyethyl)-4-(3-methylphenyl)-1-oxoisoquinolin-7-yl]cyclobutanecarboxamide Traditional Name: N-[3-amino-1-keto-2-(2-methoxyethyl)-4-(m-tolyl)-7-isoquinolyl]cyclobutanecarboxamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(N(C(=O)C3=C2C=CC(=C3)NC(=O)C4CCC4)CCOC)N

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(N(C(=O)C3=C2C=CC(=C3)NC(=O)C4CCC4)CCOC)N

InChI

InChI=1S/C24H27N3O3/c1-15-5-3-8-17(13-15)21-19-10-9-18(26-23(28)16-6-4-7-16)14-20(19)24(29)27(22(21)25)11-12-30-2/h3,5,8-10,13-14,16H,4,6-7,11-12,25H2,1-2H3,(H,26,28)