N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxidanylidene-4,6,11,11a-tetrahydropyrazino[1,2-b]isoquinoline-3-carboxamide

Systemtic Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxidanylidene-4,6,11,11a-tetrahydropyrazino[1,2-b]isoquinoline-3-carboxamide Openeye Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4,6,11,11a-tetrahydropyrazino[1,2-b]isoquinoline-3-carboxamide CAS Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4,6,11,11a-tetrahydropyrazino[1,2-b]isoquinoline-3-carboxamide IUPAC Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4,6,11,11a-tetrahydropyrazino[1,2-b]isoquinoline-3-carboxamide Traditional Name: N-cycloheptyl-1-keto-3-methyl-2-p-anisyl-4,6,11,11a-tetrahydropyrazin[1,2-b]isoquinoline-3-carboxamide Formula: C29H37N3O3 MolecularWeight: 475.62238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN2CC3=CC=CC=C3CC2C(=O)N1CC4=CC=C(C=C4)OC)C(=O)NC5CCCCCC5

Isomeric SMILES

CC1(CN2CC3=CC=CC=C3CC2C(=O)N1CC4=CC=C(C=C4)OC)C(=O)NC5CCCCCC5

InChI

InChI=1S/C29H37N3O3/c1-29(28(34)30-24-11-5-3-4-6-12-24)20-31-19-23-10-8-7-9-22(23)17-26(31)27(33)32(29)18-21-13-15-25(35-2)16-14-21/h7-10,13-16,24,26H,3-6,11-12,17-20H2,1-2H3,(H,30,34)