(phenylmethyl) N-[(4S,5S)-8-oxidanyl-2-oxidanylidene-1-(4-oxidanylidenequinazolin-3-yl)-5-phenylmethoxy-octan-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(4S,5S)-8-oxidanyl-2-oxidanylidene-1-(4-oxidanylidenequinazolin-3-yl)-5-phenylmethoxy-octan-4-yl]carbamate Openeye Name: benzyl N-[(1S,2S)-2-benzyloxy-5-hydroxy-1-[2-oxo-3-(4-oxoquinazolin-3-yl)propyl]pentyl]carbamate CAS Name: N-[(4S,5S)-8-hydroxy-2-oxo-1-(4-oxo-3-quinazolinyl)-5-phenylmethoxyoctan-4-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4S,5S)-8-hydroxy-2-oxo-1-(4-oxoquinazolin-3-yl)-5-phenylmethoxyoctan-4-yl]carbamate Traditional Name: N-[(1S,2S)-2-benzoxy-5-hydroxy-1-[2-keto-3-(4-ketoquinazolin-3-yl)propyl]pentyl]carbamic acid benzyl ester Formula: C31H33N3O6 MolecularWeight: 543.61022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(CCCO)C(CC(=O)CN2C=NC3=CC=CC=C3C2=O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CO[C@@H](CCCO)[C@H](CC(=O)CN2C=NC3=CC=CC=C3C2=O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H33N3O6/c35-17-9-16-29(39-20-23-10-3-1-4-11-23)28(33-31(38)40-21-24-12-5-2-6-13-24)18-25(36)19-34-22-32-27-15-8-7-14-26(27)30(34)37/h1-8,10-15,22,28-29,35H,9,16-21H2,(H,33,38)/t28-,29-/m0/s1