3-[3-methoxy-6,12-bis(oxidanylidene)-11-propyl-benzo[c][1,5]benzodiazocin-5-yl]propyl-trimethyl-azanium

Systemtic Name: 3-[3-methoxy-6,12-bis(oxidanylidene)-11-propyl-benzo[c][1,5]benzodiazocin-5-yl]propyl-trimethyl-azanium Openeye Name: 3-(3-methoxy-6,12-dioxo-11-propyl-benzo[c][1,5]benzodiazocin-5-yl)propyl-trimethyl-ammonium CAS Name: 3-(3-methoxy-6,12-dioxo-11-propyl-5-benzo[c][1,5]benzodiazocinyl)propyl-trimethylammonium IUPAC Name: 3-(3-methoxy-6,12-dioxo-11-propylbenzo[c][1,5]benzodiazocin-5-yl)propyl-trimethylazanium Traditional Name: 3-(6,12-diketo-3-methoxy-11-propyl-benzo[c][1,5]benzodiazocin-5-yl)propyl-trimethyl-ammonium Formula: C24H32N3O3+ MolecularWeight: 410.52918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=O)N(C3=C(C1=O)C=CC(=C3)OC)CCC[N+](C)(C)C

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=O)N(C3=C(C1=O)C=CC(=C3)OC)CCC[N+](C)(C)C

InChI

InChI=1S/C24H32N3O3/c1-6-14-25-21-11-8-7-10-19(21)23(28)26(15-9-16-27(2,3)4)22-17-18(30-5)12-13-20(22)24(25)29/h7-8,10-13,17H,6,9,14-16H2,1-5H3/q+1