(phenylmethyl) N-[6-[1-oxidanyl-3-oxidanylidene-2-[(1R)-1-phenylethyl]isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[6-[1-oxidanyl-3-oxidanylidene-2-[(1R)-1-phenylethyl]isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate Openeye Name: benzyl N-[6-[1-hydroxy-3-oxo-2-[(1R)-1-phenylethyl]isoindolin-1-yl]-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[1-hydroxy-3-oxo-2-[(1R)-1-phenylethyl]-1-isoindolyl]-1H-benzimidazol-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-[1-hydroxy-3-oxo-2-[(1R)-1-phenylethyl]isoindol-1-yl]-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[1-hydroxy-3-keto-2-[(1R)-1-phenylethyl]isoindolin-1-yl]-1H-benzimidazol-2-yl]carbamic acid benzyl ester Formula: C31H26N4O4 MolecularWeight: 518.56254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2(C4=CC5=C(C=C4)N=C(N5)NC(=O)OCC6=CC=CC=C6)O

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2(C4=CC5=C(C=C4)N=C(N5)NC(=O)OCC6=CC=CC=C6)O

InChI

InChI=1S/C31H26N4O4/c1-20(22-12-6-3-7-13-22)35-28(36)24-14-8-9-15-25(24)31(35,38)23-16-17-26-27(18-23)33-29(32-26)34-30(37)39-19-21-10-4-2-5-11-21/h2-18,20,38H,19H2,1H3,(H2,32,33,34,37)/t20-,31?/m1/s1