(2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) (E)-octadec-9-enoate

Systemtic Name: (2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) (E)-octadec-9-enoate Openeye Name: (2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid (2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) ester IUPAC Name: (2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid (2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-yl) ester Formula: C36H49N2O2+ MolecularWeight: 541.78646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC1=CC2=C(C=C1)NC3=C(C4=C(C=[N+](C=C4)C)C(=C23)C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC1=CC2=C(C=C1)NC3=C(C4=C(C=[N+](C=C4)C)C(=C23)C)C

InChI

InChI=1S/C36H48N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-34(39)40-29-21-22-33-31(25-29)35-27(2)32-26-38(4)24-23-30(32)28(3)36(35)37-33/h12-13,21-26H,5-11,14-20H2,1-4H3/p+1/b13-12+