methyl 5-chloranyl-3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-chloro-3-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-chloro-3-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-1H-indole-2-carboxylic acid methyl ester Formula: C23H24ClN3O5 MolecularWeight: 457.90676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=C(NC4=C3C=C(C=C4)Cl)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC(=O)NC3=C(NC4=C3C=C(C=C4)Cl)C(=O)OC)OC

InChI

InChI=1S/C23H24ClN3O5/c1-30-18-8-13-6-7-27(11-14(13)9-19(18)31-2)12-20(28)26-21-16-10-15(24)4-5-17(16)25-22(21)23(29)32-3/h4-5,8-10,25H,6-7,11-12H2,1-3H3,(H,26,28)