2-[3-[2-(1H-indol-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[3-[2-(1H-indol-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[3-[2-(1H-indol-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one CAS Name: 2-[3-[2-(1H-indol-3-yl)ethyl-methylamino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[3-[2-(1H-indol-3-yl)ethyl-methylamino]propyl]-5,6-dimethyl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[3-[2-(1H-indol-3-yl)ethyl-methyl-amino]propyl]-5,6-dimethyl-3,4-dihydroisocarbostyril Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCC3=CNC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N(CC2)CCCN(C)CCC3=CNC4=CC=CC=C43)C

InChI

InChI=1S/C25H31N3O/c1-18-9-10-23-21(19(18)2)12-16-28(25(23)29)14-6-13-27(3)15-11-20-17-26-24-8-5-4-7-22(20)24/h4-5,7-10,17,26H,6,11-16H2,1-3H3