propyl 4-[[3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-oxazol-5-yl]methyl-pyridin-3-ylcarbonyl-amino]benzoate

Systemtic Name: propyl 4-[[3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-oxazol-5-yl]methyl-pyridin-3-ylcarbonyl-amino]benzoate Openeye Name: propyl 4-[[3-[(4-methoxyphenyl)methylcarbamoyl]isoxazol-5-yl]methyl-(pyridine-3-carbonyl)amino]benzoate CAS Name: 4-[[3-[[(4-methoxyphenyl)methylamino]-oxomethyl]-5-isoxazolyl]methyl-[oxo(3-pyridinyl)methyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-oxazol-5-yl]methyl-(pyridine-3-carbonyl)amino]benzoate Traditional Name: 4-[nicotinoyl-[[3-(p-anisylcarbamoyl)isoxazol-5-yl]methyl]amino]benzoic acid propyl ester Formula: C29H28N4O6 MolecularWeight: 528.55582

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)OC)C(=O)C4=CN=CC=C4

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)OC)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C29H28N4O6/c1-3-15-38-29(36)21-8-10-23(11-9-21)33(28(35)22-5-4-14-30-18-22)19-25-16-26(32-39-25)27(34)31-17-20-6-12-24(37-2)13-7-20/h4-14,16,18H,3,15,17,19H2,1-2H3,(H,31,34)