(9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl heptanoate

Systemtic Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl heptanoate Openeye Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl heptanoate CAS Name: heptanoic acid (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester IUPAC Name: (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl heptanoate Traditional Name: enanthic acid (9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)methyl ester Formula: C26H31N2O3+ MolecularWeight: 419.53594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=C(N3)C=CC(=C4)OC)C

Isomeric SMILES

CCCCCCC(=O)OC[N+]1=CC2=C(C=C1)C(=C3C(=C2C)C4=C(N3)C=CC(=C4)OC)C

InChI

InChI=1S/C26H30N2O3/c1-5-6-7-8-9-24(29)31-16-28-13-12-20-18(3)26-25(17(2)22(20)15-28)21-14-19(30-4)10-11-23(21)27-26/h10-15H,5-9,16H2,1-4H3/p+1