ethyl 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methylpiperidin-1-yl]propanoyl]amino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methylpiperidin-1-yl]propanoyl]amino]-1H-indole-2-carboxylate Openeye Name: ethyl 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methyl-1-piperidyl]propanoyl]amino]-1H-indole-2-carboxylate CAS Name: 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methyl-1-piperidinyl]-1-oxopropyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methylpiperidin-1-yl]propanoyl]amino]-1H-indole-2-carboxylate Traditional Name: 5,6-dimethoxy-3-[[(2S)-2-[(3S)-3-methylpiperidino]propanoyl]amino]-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)C(C)N3CCCC(C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)[C@H](C)N3CCC[C@@H](C3)C

InChI

InChI=1S/C22H31N3O5/c1-6-30-22(27)20-19(15-10-17(28-4)18(29-5)11-16(15)23-20)24-21(26)14(3)25-9-7-8-13(2)12-25/h10-11,13-14,23H,6-9,12H2,1-5H3,(H,24,26)/t13-,14-/m0/s1