2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(3-ethoxycarbonyl-4-benzo[h]quinolin-1-iumyl)amino]ethyl-diethylammonium IUPAC Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-diethylazanium Traditional Name: 2-[(3-carbethoxybenzo[h]quinolin-1-ium-4-yl)amino]ethyl-diethyl-ammonium Formula: C22H29N3O2+2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=C2C=CC3=CC=CC=C3C2=[NH+]C=C1C(=O)OCC

Isomeric SMILES

CC[NH+](CC)CCNC1=C2C=CC3=CC=CC=C3C2=[NH+]C=C1C(=O)OCC

InChI

InChI=1S/C22H27N3O2/c1-4-25(5-2)14-13-23-21-18-12-11-16-9-7-8-10-17(16)20(18)24-15-19(21)22(26)27-6-3/h7-12,15H,4-6,13-14H2,1-3H3,(H,23,24)/p+2