tert-butyl 4-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27N3O5/c1-12-17(24)22-15-11-14(5-6-16(15)27-12)21-18(25)13-7-9-23(10-8-13)19(26)28-20(2,3)4/h5-6,11-13H,7-10H2,1-4H3,(H,21,25)(H,22,24)