6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium

Systemtic Name: 6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium Openeye Name: 6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium CAS Name: 6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium IUPAC Name: 6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium Traditional Name: 6,9,12-trimethyl-5,11-dihydropyrido[3,2-c][1,5]benzodiazocin-1-ium Formula: C16H20N3+ MolecularWeight: 254.3501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC3=C([NH+]=CC=C3)N(C2)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC3=C([NH+]=CC=C3)N(C2)C)C

InChI

InChI=1S/C16H19N3/c1-12-6-7-15-14(9-12)11-19(3)16-13(10-18(15)2)5-4-8-17-16/h4-9H,10-11H2,1-3H3/p+1