heptyl N-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]carbamate

Systemtic Name: heptyl N-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]carbamate Openeye Name: heptyl N-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]carbamate CAS Name: N-[(E)-[(E)-3-(5-nitro-2-furanyl)prop-2-enylidene]amino]carbamic acid heptyl ester IUPAC Name: heptyl N-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]carbamate Traditional Name: N-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]carbamic acid heptyl ester Formula: C15H21N3O5 MolecularWeight: 323.34434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)NN=CC=CC1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCOC(=O)N/N=C/C=C/C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5/c1-2-3-4-5-6-12-22-15(19)17-16-11-7-8-13-9-10-14(23-13)18(20)21/h7-11H,2-6,12H2,1H3,(H,17,19)/b8-7+,16-11+