methyl (2S)-1-(4-ethoxycarbonyl-8-imidazo[1,5-a]pyridin-5-yl-octanoyl)-2,3-dihydroindole-2-carboxylate

Systemtic Name: methyl (2S)-1-(4-ethoxycarbonyl-8-imidazo[1,5-a]pyridin-5-yl-octanoyl)-2,3-dihydroindole-2-carboxylate Openeye Name: methyl (2S)-1-(4-ethoxycarbonyl-8-imidazo[1,5-a]pyridin-5-yl-octanoyl)indoline-2-carboxylate CAS Name: (2S)-1-[4-ethoxycarbonyl-8-(5-imidazo[1,5-a]pyridinyl)-1-oxooctyl]-2,3-dihydroindole-2-carboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(4-ethoxycarbonyl-8-imidazo[1,5-a]pyridin-5-yloctanoyl)-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-(4-carbethoxy-8-imidazo[1,5-a]pyridin-5-yl-octanoyl)indoline-2-carboxylic acid methyl ester Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCC1=CC=CC2=CN=CN21)CCC(=O)N3C(CC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CCOC(=O)C(CCCCC1=CC=CC2=CN=CN21)CCC(=O)N3[C@@H](CC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C28H33N3O5/c1-3-36-27(33)20(9-4-6-11-22-12-8-13-23-18-29-19-30(22)23)15-16-26(32)31-24-14-7-5-10-21(24)17-25(31)28(34)35-2/h5,7-8,10,12-14,18-20,25H,3-4,6,9,11,15-17H2,1-2H3/t20?,25-/m0/s1