ethyl 5-acetyloxy-2-methyl-6,8-diphenyl-1-(phenylmethyl)pyrrolo[2,3-e]indazole-3-carboxylate

Systemtic Name: ethyl 5-acetyloxy-2-methyl-6,8-diphenyl-1-(phenylmethyl)pyrrolo[2,3-e]indazole-3-carboxylate Openeye Name: ethyl 5-acetoxy-1-benzyl-2-methyl-6,8-diphenyl-pyrrolo[2,3-e]indazole-3-carboxylate CAS Name: 5-acetyloxy-2-methyl-6,8-diphenyl-1-(phenylmethyl)-3-pyrrolo[2,3-e]indazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyloxy-1-benzyl-2-methyl-6,8-diphenylpyrrolo[2,3-e]indazole-3-carboxylate Traditional Name: 5-acetoxy-1-benzyl-2-methyl-6,8-diphenyl-pyrrol[2,3-e]indazole-3-carboxylic acid ethyl ester Formula: C34H29N3O4 MolecularWeight: 543.61176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C3C(=C(C=C12)OC(=O)C)N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C3C(=C(C=C12)OC(=O)C)N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6)C

InChI

InChI=1S/C34H29N3O4/c1-4-40-34(39)29-22(2)36(21-24-14-8-5-9-15-24)32-27(29)20-28(41-23(3)38)33-30(32)31(25-16-10-6-11-17-25)35-37(33)26-18-12-7-13-19-26/h5-20H,4,21H2,1-3H3