(5S)-5-phenyl-3-prop-2-enyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

Systemtic Name: (5S)-5-phenyl-3-prop-2-enyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Openeye Name: (5S)-3-allyl-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium CAS Name: (5S)-5-phenyl-3-prop-2-enyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium IUPAC Name: (5S)-5-phenyl-3-prop-2-enyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Traditional Name: (5S)-3-allyl-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium Formula: C19H22N+ MolecularWeight: 264.38468

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCC2=CC=CC=C2C(C1)C3=CC=CC=C3

Isomeric SMILES

C=CC[NH+]1CCC2=CC=CC=C2[C@@H](C1)C3=CC=CC=C3

InChI

InChI=1S/C19H21N/c1-2-13-20-14-12-17-10-6-7-11-18(17)19(15-20)16-8-4-3-5-9-16/h2-11,19H,1,12-15H2/p+1/t19-/m0/s1