tert-butyl N-[[4-[1-(dimethylcarbamoyl)indol-1-ium-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[1-(dimethylcarbamoyl)indol-1-ium-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[1-(dimethylcarbamoyl)indol-1-ium-1-carbonyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[1-[dimethylamino(oxo)methyl]-1-indol-1-iumyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[1-(dimethylcarbamoyl)indol-1-ium-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-[1-(dimethylcarbamoyl)indol-1-ium-1-carbonyl]benzyl]carbamic acid tert-butyl ester Formula: C24H28N3O4+ MolecularWeight: 422.49682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)[N+]2(C=CC3=CC=CC=C32)C(=O)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)[N+]2(C=CC3=CC=CC=C32)C(=O)N(C)C

InChI

InChI=1S/C24H27N3O4/c1-24(2,3)31-22(29)25-16-17-10-12-19(13-11-17)21(28)27(23(30)26(4)5)15-14-18-8-6-7-9-20(18)27/h6-15H,16H2,1-5H3/p+1