(phenylmethyl) 2-chloranyl-3-[[6-chloranyl-5-(2-methylpropyl)-3-oxidanylidene-4-phenylmethoxy-pyrazin-2-yl]methyl]indole-1-carboxylate

Systemtic Name: (phenylmethyl) 2-chloranyl-3-[[6-chloranyl-5-(2-methylpropyl)-3-oxidanylidene-4-phenylmethoxy-pyrazin-2-yl]methyl]indole-1-carboxylate Openeye Name: benzyl 3-[(4-benzyloxy-6-chloro-5-isobutyl-3-oxo-pyrazin-2-yl)methyl]-2-chloro-indole-1-carboxylate CAS Name: 2-chloro-3-[[6-chloro-5-(2-methylpropyl)-3-oxo-4-phenylmethoxy-2-pyrazinyl]methyl]-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-3-[[6-chloro-5-(2-methylpropyl)-3-oxo-4-phenylmethoxypyrazin-2-yl]methyl]indole-1-carboxylate Traditional Name: 3-[(4-benzoxy-6-chloro-5-isobutyl-3-keto-pyrazin-2-yl)methyl]-2-chloro-indole-1-carboxylic acid benzyl ester Formula: C32H29Cl2N3O4 MolecularWeight: 590.49636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(C(=O)N1OCC2=CC=CC=C2)CC3=C(N(C4=CC=CC=C43)C(=O)OCC5=CC=CC=C5)Cl)Cl

Isomeric SMILES

CC(C)CC1=C(N=C(C(=O)N1OCC2=CC=CC=C2)CC3=C(N(C4=CC=CC=C43)C(=O)OCC5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C32H29Cl2N3O4/c1-21(2)17-28-29(33)35-26(31(38)37(28)41-20-23-13-7-4-8-14-23)18-25-24-15-9-10-16-27(24)36(30(25)34)32(39)40-19-22-11-5-3-6-12-22/h3-16,21H,17-20H2,1-2H3