2-azanyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-6-(2-phenylmethoxyphenyl)pyridine-3-carboxylic acid

Systemtic Name: 2-azanyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-6-(2-phenylmethoxyphenyl)pyridine-3-carboxylic acid Openeye Name: 2-amino-6-(2-benzyloxyphenyl)-4-(1-tert-butoxycarbonyl-3-piperidyl)pyridine-3-carboxylic acid CAS Name: 2-amino-4-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]-6-(2-phenylmethoxyphenyl)-3-pyridinecarboxylic acid IUPAC Name: 2-amino-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-6-(2-phenylmethoxyphenyl)pyridine-3-carboxylic acid Traditional Name: 2-amino-6-(2-benzoxyphenyl)-4-(1-tert-butoxycarbonyl-3-piperidyl)nicotinic acid Formula: C29H33N3O5 MolecularWeight: 503.58942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2C(=O)O)N)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C2=CC(=NC(=C2C(=O)O)N)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C29H33N3O5/c1-29(2,3)37-28(35)32-15-9-12-20(17-32)22-16-23(31-26(30)25(22)27(33)34)21-13-7-8-14-24(21)36-18-19-10-5-4-6-11-19/h4-8,10-11,13-14,16,20H,9,12,15,17-18H2,1-3H3,(H2,30,31)(H,33,34)