N-[(4-methylphenyl)methyl]-5-[[3-phenylpropanoyl(prop-2-enyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-5-[[3-phenylpropanoyl(prop-2-enyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[allyl(3-phenylpropanoyl)amino]methyl]-N-(p-tolylmethyl)isoxazole-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-5-[[(1-oxo-3-phenylpropyl)-prop-2-enylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-5-[[3-phenylpropanoyl(prop-2-enyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[allyl(hydrocinnamoyl)amino]methyl]-N-(4-methylbenzyl)isoxazole-3-carboxamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC=C)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC=C)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c1-3-15-28(24(29)14-13-20-7-5-4-6-8-20)18-22-16-23(27-31-22)25(30)26-17-21-11-9-19(2)10-12-21/h3-12,16H,1,13-15,17-18H2,2H3,(H,26,30)