tert-butyl 2-(4-aminophenyl)carbonyl-1,2-diazinane-1-carboxylate

Systemtic Name: tert-butyl 2-(4-aminophenyl)carbonyl-1,2-diazinane-1-carboxylate Openeye Name: tert-butyl 2-(4-aminobenzoyl)hexahydropyridazine-1-carboxylate CAS Name: 2-[(4-aminophenyl)-oxomethyl]-1-diazinanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-aminobenzoyl)diazinane-1-carboxylate Traditional Name: 2-(4-aminobenzoyl)hexahydropyridazine-1-carboxylic acid tert-butyl ester Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCN1C(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCN1C(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H23N3O3/c1-16(2,3)22-15(21)19-11-5-4-10-18(19)14(20)12-6-8-13(17)9-7-12/h6-9H,4-5,10-11,17H2,1-3H3