(4R)-4-(1H-indol-6-ylcarbonylamino)-2-methyl-5-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4R)-4-(1H-indol-6-ylcarbonylamino)-2-methyl-5-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (4R)-4-(1H-indole-6-carbonylamino)-2-methyl-5-[4-(1-methyl-4-piperidyl)-1-piperidyl]-5-oxo-pentanoic acid CAS Name: (4R)-4-[[1H-indol-6-yl(oxo)methyl]amino]-2-methyl-5-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-5-oxopentanoic acid IUPAC Name: (4R)-4-(1H-indole-6-carbonylamino)-2-methyl-5-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-5-oxopentanoic acid Traditional Name: (4R)-4-(1H-indole-6-carbonylamino)-5-keto-2-methyl-5-[4-(1-methyl-4-piperidyl)piperidino]valeric acid Formula: C26H36N4O4 MolecularWeight: 468.58844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)N1CCC(CC1)C2CCN(CC2)C)NC(=O)C3=CC4=C(C=C3)C=CN4)C(=O)O

Isomeric SMILES

CC(C[C@H](C(=O)N1CCC(CC1)C2CCN(CC2)C)NC(=O)C3=CC4=C(C=C3)C=CN4)C(=O)O

InChI

InChI=1S/C26H36N4O4/c1-17(26(33)34)15-23(28-24(31)21-4-3-20-5-10-27-22(20)16-21)25(32)30-13-8-19(9-14-30)18-6-11-29(2)12-7-18/h3-5,10,16-19,23,27H,6-9,11-15H2,1-2H3,(H,28,31)(H,33,34)/t17?,23-/m1/s1