10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepino[4,5-b]indole

Systemtic Name: 10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepino[4,5-b]indole Openeye Name: 10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepino[4,5-b]indole CAS Name: 10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepino[4,5-b]indole IUPAC Name: 10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepino[4,5-b]indole Traditional Name: 10-(2-butoxyphenyl)-1,2,3,4,5,5a,6,10b-octahydroazepin[4,5-b]indole Formula: C22H28N2O MolecularWeight: 336.47052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2=C3C4CCNCCC4NC3=CC=C2

Isomeric SMILES

CCCCOC1=CC=CC=C1C2=C3C4CCNCCC4NC3=CC=C2

InChI

InChI=1S/C22H28N2O/c1-2-3-15-25-21-10-5-4-7-16(21)17-8-6-9-20-22(17)18-11-13-23-14-12-19(18)24-20/h4-10,18-19,23-24H,2-3,11-15H2,1H3