tert-butyl 4-[[3-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[3-[[(2-amino-2-oxoethyl)amino]-oxomethyl]anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-[(2-amino-2-oxoethyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-[(2-amino-2-keto-ethyl)carbamoyl]phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O5/c1-20(2,3)29-19(28)24-9-7-13(8-10-24)18(27)23-15-6-4-5-14(11-15)17(26)22-12-16(21)25/h4-6,11,13H,7-10,12H2,1-3H3,(H2,21,25)(H,22,26)(H,23,27)