(phenylmethyl) N-[1-(3-nitrophenyl)but-3-enyl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(3-nitrophenyl)but-3-enyl]carbamate Openeye Name: benzyl N-[1-(3-nitrophenyl)but-3-enyl]carbamate CAS Name: N-[1-(3-nitrophenyl)but-3-enyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(3-nitrophenyl)but-3-enyl]carbamate Traditional Name: N-[1-(3-nitrophenyl)but-3-enyl]carbamic acid benzyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C=CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O4/c1-2-7-17(15-10-6-11-16(12-15)20(22)23)19-18(21)24-13-14-8-4-3-5-9-14/h2-6,8-12,17H,1,7,13H2,(H,19,21)