3-(2-chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-azanium

Systemtic Name: 3-(2-chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-azanium Openeye Name: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-ammonium CAS Name: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylammonium IUPAC Name: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methylazanium Traditional Name: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-methyl-ammonium Formula: C18H22ClN2+ MolecularWeight: 301.83368

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl

Isomeric SMILES

C[NH2+]CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN2/c1-20-11-4-12-21-17-6-3-2-5-14(17)7-8-15-9-10-16(19)13-18(15)21/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3/p+1