(3R)-3-(1H-indol-6-ylcarbonylamino)-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: (3R)-3-(1H-indol-6-ylcarbonylamino)-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: (3R)-3-(1H-indole-6-carbonylamino)-4-[4-(1-methyl-4-piperidyl)-1-piperidyl]-4-oxo-butanoic acid CAS Name: (3R)-3-[[1H-indol-6-yl(oxo)methyl]amino]-4-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-4-oxobutanoic acid IUPAC Name: (3R)-3-(1H-indole-6-carbonylamino)-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxobutanoic acid Traditional Name: (3R)-3-(1H-indole-6-carbonylamino)-4-keto-4-[4-(1-methyl-4-piperidyl)piperidino]butyric acid Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CC(=O)O)NC(=O)C3=CC4=C(C=C3)C=CN4

Isomeric SMILES

CN1CCC(CC1)C2CCN(CC2)C(=O)[C@@H](CC(=O)O)NC(=O)C3=CC4=C(C=C3)C=CN4

InChI

InChI=1S/C24H32N4O4/c1-27-10-5-16(6-11-27)17-7-12-28(13-8-17)24(32)21(15-22(29)30)26-23(31)19-3-2-18-4-9-25-20(18)14-19/h2-4,9,14,16-17,21,25H,5-8,10-13,15H2,1H3,(H,26,31)(H,29,30)/t21-/m1/s1