4-bromanyl-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)indole-2,3-dione

Systemtic Name: 4-bromanyl-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)indole-2,3-dione Openeye Name: 4-bromo-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)indoline-2,3-dione CAS Name: 4-bromo-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)indole-2,3-dione IUPAC Name: 4-bromo-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)indole-2,3-dione Traditional Name: 4-bromo-5-methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isatin Formula: C19H18BrN2O2+ MolecularWeight: 386.26242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCC4=CC=CC=C4C3)Br

Isomeric SMILES

CC1=C(C2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCC4=CC=CC=C4C3)Br

InChI

InChI=1S/C19H17BrN2O2/c1-12-6-7-15-16(17(12)20)18(23)19(24)22(15)11-21-9-8-13-4-2-3-5-14(13)10-21/h2-7H,8-11H2,1H3/p+1