(4-propan-2-ylphenyl)methyl 4-[(pyridin-4-ylcarbonylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (4-propan-2-ylphenyl)methyl 4-[(pyridin-4-ylcarbonylamino)methyl]piperidine-1-carboxylate Openeye Name: (4-isopropylphenyl)methyl 4-[(pyridine-4-carbonylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[[[oxo(pyridin-4-yl)methyl]amino]methyl]-1-piperidinecarboxylic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 4-[(pyridine-4-carbonylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-(isonicotinamidomethyl)piperidine-1-carboxylic acid (4-isopropylbenzyl) ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)N2CCC(CC2)CNC(=O)C3=CC=NC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)N2CCC(CC2)CNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C23H29N3O3/c1-17(2)20-5-3-19(4-6-20)16-29-23(28)26-13-9-18(10-14-26)15-25-22(27)21-7-11-24-12-8-21/h3-8,11-12,17-18H,9-10,13-16H2,1-2H3,(H,25,27)