(phenylmethyl) 2-[[1-[(5-methylfuran-2-yl)methyl]aziridin-2-yl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 2-[[1-[(5-methylfuran-2-yl)methyl]aziridin-2-yl]carbonylamino]propanoate Openeye Name: benzyl 2-[[1-[(5-methyl-2-furyl)methyl]aziridine-2-carbonyl]amino]propanoate CAS Name: 2-[[[1-[(5-methyl-2-furanyl)methyl]-2-aziridinyl]-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-[(5-methylfuran-2-yl)methyl]aziridine-2-carbonyl]amino]propanoate Traditional Name: 2-[[1-[(5-methyl-2-furyl)methyl]ethylenimine-2-carbonyl]amino]propionic acid benzyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2CC2C(=O)NC(C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(O1)CN2CC2C(=O)NC(C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O4/c1-13-8-9-16(25-13)10-21-11-17(21)18(22)20-14(2)19(23)24-12-15-6-4-3-5-7-15/h3-9,14,17H,10-12H2,1-2H3,(H,20,22)