ethyl 4-[[[(5R)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl-prop-2-enyl-carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[[(5R)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl-prop-2-enyl-carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[allyl-[[(5R)-3-phenyl-4,5-dihydroisoxazol-5-yl]methyl]carbamoyl]amino]benzoate CAS Name: 4-[[oxo-[[(5R)-3-phenyl-4,5-dihydroisoxazol-5-yl]methyl-prop-2-enylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[(5R)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl-prop-2-enylcarbamoyl]amino]benzoate Traditional Name: 4-[[allyl-[[(5R)-3-phenyl-2-isoxazolin-5-yl]methyl]carbamoyl]amino]benzoic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N(CC=C)CC2CC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N(CC=C)C[C@H]2CC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-3-14-26(16-20-15-21(25-30-20)17-8-6-5-7-9-17)23(28)24-19-12-10-18(11-13-19)22(27)29-4-2/h3,5-13,20H,1,4,14-16H2,2H3,(H,24,28)/t20-/m1/s1