4-chloranyl-N-[2-oxidanylidene-2-[5-[(2-phenylmethoxyphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-oxidanylidene-2-[5-[(2-phenylmethoxyphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]ethyl]benzamide Openeye Name: N-[2-[5-[(2-benzyloxyphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-oxo-ethyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[2-oxo-2-[5-[(2-phenylmethoxyphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]ethyl]benzamide IUPAC Name: 4-chloro-N-[2-oxo-2-[5-[(2-phenylmethoxyphenyl)methyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]ethyl]benzamide Traditional Name: N-[2-[5-(2-benzoxybenzyl)-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-1-yl]-2-keto-ethyl]-4-chloro-benzamide Formula: C29H30ClN3O3 MolecularWeight: 504.0198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2C1CN(C2)CC3=CC=CC=C3OCC4=CC=CC=C4)C(=O)CNC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(C2C1CN(C2)CC3=CC=CC=C3OCC4=CC=CC=C4)C(=O)CNC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H30ClN3O3/c30-25-12-10-22(11-13-25)29(35)31-16-28(34)33-15-14-23-17-32(19-26(23)33)18-24-8-4-5-9-27(24)36-20-21-6-2-1-3-7-21/h1-13,23,26H,14-20H2,(H,31,35)