tert-butyl N-[(2R)-4,7-dimethanoyl-5-phenylmethoxy-1,2-dihydropyrrolo[1,2-a]indol-9-ium-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-4,7-dimethanoyl-5-phenylmethoxy-1,2-dihydropyrrolo[1,2-a]indol-9-ium-2-yl]carbamate Openeye Name: tert-butyl N-[(2R)-5-benzyloxy-4,7-diformyl-1,2-dihydropyrrolo[1,2-a]indol-9-ium-2-yl]carbamate CAS Name: N-[(2R)-4,7-diformyl-5-phenylmethoxy-1,2-dihydropyrrolo[1,2-a]indol-9-ium-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-4,7-diformyl-5-phenylmethoxy-1,2-dihydropyrrolo[1,2-a]indol-9-ium-2-yl]carbamate Traditional Name: N-[(2R)-5-benzoxy-4,7-diformyl-1,2-dihydropyrrol[1,2-a]indol-9-ium-2-yl]carbamic acid tert-butyl ester Formula: C25H25N2O5+ MolecularWeight: 433.4764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1C[N+]2=C3C=C(C=C(C3=C(C2=C1)C=O)OCC4=CC=CC=C4)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]1C[N+]2=C3C=C(C=C(C3=C(C2=C1)C=O)OCC4=CC=CC=C4)C=O

InChI

InChI=1S/C25H24N2O5/c1-25(2,3)32-24(30)26-18-11-20-19(14-29)23-21(27(20)12-18)9-17(13-28)10-22(23)31-15-16-7-5-4-6-8-16/h4-11,13-14,18H,12,15H2,1-3H3/p+1/t18-/m1/s1