ethyl 5-ethoxy-3-[2-[(2S)-2-ethylpiperidin-1-yl]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-ethoxy-3-[2-[(2S)-2-ethylpiperidin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-ethoxy-3-[[2-[(2S)-2-ethyl-1-piperidyl]acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-ethoxy-3-[[2-[(2S)-2-ethyl-1-piperidinyl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-ethoxy-3-[[2-[(2S)-2-ethylpiperidin-1-yl]acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-ethoxy-3-[[2-[(2S)-2-ethylpiperidino]acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC(=O)NC2=C(NC3=C2C=C(C=C3)OCC)C(=O)OCC

Isomeric SMILES

CC[C@H]1CCCCN1CC(=O)NC2=C(NC3=C2C=C(C=C3)OCC)C(=O)OCC

InChI

InChI=1S/C22H31N3O4/c1-4-15-9-7-8-12-25(15)14-19(26)24-20-17-13-16(28-5-2)10-11-18(17)23-21(20)22(27)29-6-3/h10-11,13,15,23H,4-9,12,14H2,1-3H3,(H,24,26)/t15-/m0/s1