N-(3-pyridin-4-ylpropyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(3-pyridin-4-ylpropyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[3-(4-pyridyl)propyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide CAS Name: N-(3-pyridin-4-ylpropyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(3-pyridin-4-ylpropyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[3-(4-pyridyl)propyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide Formula: C18H27N3O MolecularWeight: 301.42648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)C(=O)NCCCC3=CC=NC=C3

Isomeric SMILES

C1CCC2CN(CCC2C1)C(=O)NCCCC3=CC=NC=C3

InChI

InChI=1S/C18H27N3O/c22-18(20-10-3-4-15-7-11-19-12-8-15)21-13-9-16-5-1-2-6-17(16)14-21/h7-8,11-12,16-17H,1-6,9-10,13-14H2,(H,20,22)