tert-butyl 4-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylcarbamoyl]-4-phenylazanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylcarbamoyl]-4-phenylazanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-anilino-4-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylcarbamoyl]piperidine-1-carboxylate CAS Name: 4-anilino-4-[oxo-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-anilino-4-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-anilino-4-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H34N4O5 MolecularWeight: 494.58266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3(CCN(CC3)C(=O)OC(C)(C)C)NC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3(CCN(CC3)C(=O)OC(C)(C)C)NC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O5/c1-18(19-10-11-22-21(16-19)29-23(32)17-35-22)28-24(33)27(30-20-8-6-5-7-9-20)12-14-31(15-13-27)25(34)36-26(2,3)4/h5-11,16,18,30H,12-15,17H2,1-4H3,(H,28,33)(H,29,32)