tert-butyl N-[(E)-3-(4-nitrophenyl)sulfanylprop-2-enyl]carbamate

Systemtic Name: tert-butyl N-[(E)-3-(4-nitrophenyl)sulfanylprop-2-enyl]carbamate Openeye Name: tert-butyl N-[(E)-3-(4-nitrophenyl)sulfanylallyl]carbamate CAS Name: N-[(E)-3-[(4-nitrophenyl)thio]prop-2-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-3-(4-nitrophenyl)sulfanylprop-2-enyl]carbamate Traditional Name: N-[(E)-3-[(4-nitrophenyl)thio]allyl]carbamic acid tert-butyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC=CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC/C=C/SC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4S/c1-14(2,3)20-13(17)15-9-4-10-21-12-7-5-11(6-8-12)16(18)19/h4-8,10H,9H2,1-3H3,(H,15,17)/b10-4+