tert-butyl 4-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(3-methoxyanilino)-2-oxo-ethyl]-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(3-methoxyanilino)-2-oxoethyl]-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-keto-2-(m-anisidino)ethyl]-methyl-carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C21H31N3O5/c1-21(2,3)29-20(27)24-11-9-15(10-12-24)19(26)23(4)14-18(25)22-16-7-6-8-17(13-16)28-5/h6-8,13,15H,9-12,14H2,1-5H3,(H,22,25)