6-methyl-3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-2-ylmethyl)chromen-4-one

Systemtic Name: 6-methyl-3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-2-ylmethyl)chromen-4-one Openeye Name: 6-methyl-3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-2-ylmethyl)chromen-4-one CAS Name: 6-methyl-3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-2-ylmethyl)-1-benzopyran-4-one IUPAC Name: 6-methyl-3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-2-ylmethyl)chromen-4-one Traditional Name: 6-methyl-3-(2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium-2-ylmethyl)chromone Formula: C22H21N2O2+ MolecularWeight: 345.41434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+]3CCC4=C(C3)NC5=CC=CC=C45

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+]3CCC4=C(C3)NC5=CC=CC=C45

InChI

InChI=1S/C22H20N2O2/c1-14-6-7-21-18(10-14)22(25)15(13-26-21)11-24-9-8-17-16-4-2-3-5-19(16)23-20(17)12-24/h2-7,10,13,23H,8-9,11-12H2,1H3/p+1