7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

Systemtic Name: 7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Openeye Name: 7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium CAS Name: 7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium IUPAC Name: 7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Traditional Name: 7,8-dipropoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C2CC[NH2+]CCC2=C1)OCCC

Isomeric SMILES

CCCOC1=C(C=C2CC[NH2+]CCC2=C1)OCCC

InChI

InChI=1S/C16H25NO2/c1-3-9-18-15-11-13-5-7-17-8-6-14(13)12-16(15)19-10-4-2/h11-12,17H,3-10H2,1-2H3/p+1