tert-butyl 4-[[2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-7-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-7-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-7-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[2-[(diaminomethylideneamino)-oxomethyl]-1,4-dimethyl-7-indolyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(diaminomethylidenecarbamoyl)-1,4-dimethylindol-7-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-7-yl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H33N5O4 MolecularWeight: 443.53922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=C(C=C1)OCC3CCN(CC3)C(=O)OC(C)(C)C)C)C(=O)N=C(N)N

Isomeric SMILES

CC1=C2C=C(N(C2=C(C=C1)OCC3CCN(CC3)C(=O)OC(C)(C)C)C)C(=O)N=C(N)N

InChI

InChI=1S/C23H33N5O4/c1-14-6-7-18(19-16(14)12-17(27(19)5)20(29)26-21(24)25)31-13-15-8-10-28(11-9-15)22(30)32-23(2,3)4/h6-7,12,15H,8-11,13H2,1-5H3,(H4,24,25,26,29)