tert-butyl 4-(6-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-chloranyl-2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carboxylate CAS Name: 4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-chloro-2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carboxylate Traditional Name: 4-(6-chloro-2-keto-4H-3,1-benzoxazin-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C18H23ClN2O4 MolecularWeight: 366.83922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(COC2=O)C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C3=C(COC2=O)C=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN2O4/c1-18(2,3)25-16(22)20-8-6-14(7-9-20)21-15-5-4-13(19)10-12(15)11-24-17(21)23/h4-5,10,14H,6-9,11H2,1-3H3