1-chloranyl-4-(2-nitro-1-pent-2-ynoxy-ethyl)benzene

Systemtic Name: 1-chloranyl-4-(2-nitro-1-pent-2-ynoxy-ethyl)benzene Openeye Name: 1-chloro-4-(2-nitro-1-pent-2-ynoxy-ethyl)benzene CAS Name: 1-chloro-4-(2-nitro-1-pent-2-ynoxyethyl)benzene IUPAC Name: 1-chloro-4-(2-nitro-1-pent-2-ynoxyethyl)benzene Traditional Name: 1-chloro-4-(2-nitro-1-pent-2-ynoxy-ethyl)benzene Formula: C13H14ClNO3 MolecularWeight: 267.70816

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC(C[N+](=O)[O-])C1=CC=C(C=C1)Cl

Isomeric SMILES

CCC#CCOC(C[N+](=O)[O-])C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H14ClNO3/c1-2-3-4-9-18-13(10-15(16)17)11-5-7-12(14)8-6-11/h5-8,13H,2,9-10H2,1H3