pentanoyl 2-azanyl-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-(triphenylmethyl)piperidine-2-carboxylate

Systemtic Name: pentanoyl 2-azanyl-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-(triphenylmethyl)piperidine-2-carboxylate Openeye Name: pentanoyl 2-amino-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-trityl-piperidine-2-carboxylate CAS Name: 2-amino-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-(triphenylmethyl)-2-piperidinecarboxylic acid 1-oxopentyl ester IUPAC Name: pentanoyl 2-amino-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-tritylpiperidine-2-carboxylate Traditional Name: 2-amino-4-ethyl-1-(1H-imidazol-5-yl)-5-methyl-5-trityl-pipecolinic acid valeryl ester Formula: C36H42N4O3 MolecularWeight: 578.74368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(=O)C1(CC(C(CN1C2=CN=CN2)(C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)CC)N

Isomeric SMILES

CCCCC(=O)OC(=O)C1(CC(C(CN1C2=CN=CN2)(C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)CC)N

InChI

InChI=1S/C36H42N4O3/c1-4-6-22-32(41)43-33(42)35(37)23-27(5-2)34(3,25-40(35)31-24-38-26-39-31)36(28-16-10-7-11-17-28,29-18-12-8-13-19-29)30-20-14-9-15-21-30/h7-21,24,26-27H,4-6,22-23,25,37H2,1-3H3,(H,38,39)