methyl 3-[1-[3-(quinolin-4-ylcarbonylamino)propyl]piperidin-4-yl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[1-[3-(quinolin-4-ylcarbonylamino)propyl]piperidin-4-yl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[1-[3-(quinoline-4-carbonylamino)propyl]-4-piperidyl]-1H-indole-5-carboxylate CAS Name: 3-[1-[3-[[oxo(4-quinolinyl)methyl]amino]propyl]-4-piperidinyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[1-[3-(quinoline-4-carbonylamino)propyl]piperidin-4-yl]-1H-indole-5-carboxylate Traditional Name: 3-[1-[3-(cinchoninoylamino)propyl]-4-piperidyl]-1H-indole-5-carboxylic acid methyl ester Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC=C2C3CCN(CC3)CCCNC(=O)C4=CC=NC5=CC=CC=C45

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC=C2C3CCN(CC3)CCCNC(=O)C4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C28H30N4O3/c1-35-28(34)20-7-8-26-23(17-20)24(18-31-26)19-10-15-32(16-11-19)14-4-12-30-27(33)22-9-13-29-25-6-3-2-5-21(22)25/h2-3,5-9,13,17-19,31H,4,10-12,14-16H2,1H3,(H,30,33)