3-oxidanidyl-3-(phenylmethyl)-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium

Systemtic Name: 3-oxidanidyl-3-(phenylmethyl)-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Openeye Name: 3-benzyl-3-oxido-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium CAS Name: 3-oxido-3-(phenylmethyl)-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium IUPAC Name: 3-benzyl-3-oxido-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Traditional Name: 3-benzyl-3-oxido-7-propyl-1,2,4,5-tetrahydro-3-benzazepin-3-ium Formula: C20H25NO MolecularWeight: 295.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(CC[N+](CC2)(CC3=CC=CC=C3)[O-])C=C1

Isomeric SMILES

CCCC1=CC2=C(CC[N+](CC2)(CC3=CC=CC=C3)[O-])C=C1

InChI

InChI=1S/C20H25NO/c1-2-6-17-9-10-19-11-13-21(22,14-12-20(19)15-17)16-18-7-4-3-5-8-18/h3-5,7-10,15H,2,6,11-14,16H2,1H3