tert-butyl N-[2-[(3-aminocarbonylcyclohexa-1,3-dien-1-yl)amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[(3-aminocarbonylcyclohexa-1,3-dien-1-yl)amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-[2-[(3-carbamoylcyclohexa-1,3-dien-1-yl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[(3-carbamoyl-1-cyclohexa-1,3-dienyl)amino]-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(3-carbamoylcyclohexa-1,3-dien-1-yl)amino]-2-oxoethyl]carbamate Traditional Name: N-[2-[(3-carbamoylcyclohexa-1,3-dien-1-yl)amino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C14H21N3O4 MolecularWeight: 295.33424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)NC1=CC(=CCC1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NC1=CC(=CCC1)C(=O)N

InChI

InChI=1S/C14H21N3O4/c1-14(2,3)21-13(20)16-8-11(18)17-10-6-4-5-9(7-10)12(15)19/h5,7H,4,6,8H2,1-3H3,(H2,15,19)(H,16,20)(H,17,18)