4-(4-ethylpiperazin-1-yl)carbonyl-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-(4-ethylpiperazin-1-yl)carbonyl-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(4-ethylpiperazine-1-carbonyl)-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 4-[(4-ethyl-1-piperazinyl)-oxomethyl]-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(4-ethylpiperazine-1-carbonyl)-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(4-ethylpiperazine-1-carbonyl)-3-(1H-indol-3-yl)-2-methyl-3,4-dihydroisocarbostyril Formula: C25H28N4O2 MolecularWeight: 416.51542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CNC5=CC=CC=C54

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H28N4O2/c1-3-28-12-14-29(15-13-28)25(31)22-18-9-4-5-10-19(18)24(30)27(2)23(22)20-16-26-21-11-7-6-8-17(20)21/h4-11,16,22-23,26H,3,12-15H2,1-2H3