ethyl 5,6-dimethoxy-3-[3-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5,6-dimethoxy-3-[3-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5,6-dimethoxy-3-[3-(4-methyl-1-piperidyl)propanoylamino]-1H-indole-2-carboxylate CAS Name: 5,6-dimethoxy-3-[[3-(4-methyl-1-piperidinyl)-1-oxopropyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-dimethoxy-3-[3-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Traditional Name: 5,6-dimethoxy-3-[3-(4-methylpiperidino)propanoylamino]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CCN3CCC(CC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CCN3CCC(CC3)C

InChI

InChI=1S/C22H31N3O5/c1-5-30-22(27)21-20(15-12-17(28-3)18(29-4)13-16(15)23-21)24-19(26)8-11-25-9-6-14(2)7-10-25/h12-14,23H,5-11H2,1-4H3,(H,24,26)