N-[4-(4-methyl-3-oxidanylidene-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)ethanamide

Systemtic Name: N-[4-(4-methyl-3-oxidanylidene-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)ethanamide Openeye Name: N-[4-(4-methyl-3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)acetamide CAS Name: N-[4-(4-methyl-3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)acetamide IUPAC Name: N-[4-(4-methyl-3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)acetamide Traditional Name: N-[4-(3-keto-4-methyl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-2-(propylamino)acetamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(=O)NC1=CC=C(C=C1)C2C3=CC=CC=C3C(C(=O)N2)C

Isomeric SMILES

CCCNCC(=O)NC1=CC=C(C=C1)C2C3=CC=CC=C3C(C(=O)N2)C

InChI

InChI=1S/C21H25N3O2/c1-3-12-22-13-19(25)23-16-10-8-15(9-11-16)20-18-7-5-4-6-17(18)14(2)21(26)24-20/h4-11,14,20,22H,3,12-13H2,1-2H3,(H,23,25)(H,24,26)