ethyl 1-[2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]piperidine-3-carboxylate CAS Name: 1-[2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)acetyl]nipecotic acid ethyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H30N2O5/c1-5-28-21(27)15-7-6-10-23(12-15)19(25)13-24-17-11-16(22(2,3)4)8-9-18(17)29-14-20(24)26/h8-9,11,15H,5-7,10,12-14H2,1-4H3