5-[2-(2-methoxy-4-methyl-morpholin-4-ium-4-yl)ethyl]-2-[(3S,4S)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]pyrido[4,3-b]indol-1-one

Systemtic Name: 5-[2-(2-methoxy-4-methyl-morpholin-4-ium-4-yl)ethyl]-2-[(3S,4S)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]pyrido[4,3-b]indol-1-one Openeye Name: 5-[2-(2-methoxy-4-methyl-morpholin-4-ium-4-yl)ethyl]-2-[(1S,2S)-1,3,3-trimethylnorbornan-2-yl]pyrido[4,3-b]indol-1-one CAS Name: 5-[2-(2-methoxy-4-methyl-4-morpholin-4-iumyl)ethyl]-2-[(3S,4S)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]-1-pyrido[4,3-b]indolone IUPAC Name: 5-[2-(2-methoxy-4-methylmorpholin-4-ium-4-yl)ethyl]-2-[(3S,4S)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]pyrido[4,3-b]indol-1-one Traditional Name: 5-[2-(2-methoxy-4-methyl-morpholin-4-ium-4-yl)ethyl]-2-[(1S,2S)-1,3,3-trimethylnorbornan-2-yl]pyrid[4,3-b]indol-1-one Formula: C29H40N3O3+ MolecularWeight: 478.6462

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(C2)(C1N3C=CC4=C(C3=O)C5=CC=CC=C5N4CC[N+]6(CCOC(C6)OC)C)C)C

Isomeric SMILES

C[C@]12CCC(C1)C([C@H]2N3C=CC4=C(C3=O)C5=CC=CC=C5N4CC[N+]6(CCOC(C6)OC)C)(C)C

InChI

InChI=1S/C29H40N3O3/c1-28(2)20-10-12-29(3,18-20)27(28)31-13-11-23-25(26(31)33)21-8-6-7-9-22(21)30(23)14-15-32(4)16-17-35-24(19-32)34-5/h6-9,11,13,20,24,27H,10,12,14-19H2,1-5H3/q+1/t20?,24?,27-,29+,32?/m1/s1