2-chloranyl-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene

Systemtic Name: 2-chloranyl-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene Openeye Name: 2-chloro-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene CAS Name: 2-chloro-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene IUPAC Name: 2-chloro-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene Traditional Name: 2-chloro-4-methyl-1,3-dinitro-5-(phenoxymethyl)benzene Formula: C14H11ClN2O5 MolecularWeight: 322.70054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1COC2=CC=CC=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1COC2=CC=CC=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN2O5/c1-9-10(8-22-11-5-3-2-4-6-11)7-12(16(18)19)13(15)14(9)17(20)21/h2-7H,8H2,1H3