tert-butyl 7-chloranyl-3-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]indole-1-carboxylate

Systemtic Name: tert-butyl 7-chloranyl-3-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]indole-1-carboxylate Openeye Name: tert-butyl 7-chloro-3-[[(2S,5R)-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazin-2-yl]methyl]indole-1-carboxylate CAS Name: 7-chloro-3-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-chloro-3-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]indole-1-carboxylate Traditional Name: 7-chloro-3-[[(2S,5R)-5-isopropyl-3,6-dimethoxy-2,5-dihydropyrazin-2-yl]methyl]indole-1-carboxylic acid tert-butyl ester Formula: C23H30ClN3O4 MolecularWeight: 447.955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=NC(C(=N1)OC)CC2=CN(C3=C2C=CC=C3Cl)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(C)[C@@H]1C(=N[C@H](C(=N1)OC)CC2=CN(C3=C2C=CC=C3Cl)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C23H30ClN3O4/c1-13(2)18-21(30-7)25-17(20(26-18)29-6)11-14-12-27(22(28)31-23(3,4)5)19-15(14)9-8-10-16(19)24/h8-10,12-13,17-18H,11H2,1-7H3/t17-,18+/m0/s1