1-(1-but-3-ynoxy-2-nitro-ethyl)-2-chloranyl-benzene

Systemtic Name: 1-(1-but-3-ynoxy-2-nitro-ethyl)-2-chloranyl-benzene Openeye Name: 1-(1-but-3-ynoxy-2-nitro-ethyl)-2-chloro-benzene CAS Name: 1-(1-but-3-ynoxy-2-nitroethyl)-2-chlorobenzene IUPAC Name: 1-(1-but-3-ynoxy-2-nitroethyl)-2-chlorobenzene Traditional Name: 1-(1-but-3-ynoxy-2-nitro-ethyl)-2-chloro-benzene Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCOC(C[N+](=O)[O-])C1=CC=CC=C1Cl

Isomeric SMILES

C#CCCOC(C[N+](=O)[O-])C1=CC=CC=C1Cl

InChI

InChI=1S/C12H12ClNO3/c1-2-3-8-17-12(9-14(15)16)10-6-4-5-7-11(10)13/h1,4-7,12H,3,8-9H2