3-chloranyl-4-methyl-N-[(5-nitrofuran-2-yl)methyl]aniline

Systemtic Name: 3-chloranyl-4-methyl-N-[(5-nitrofuran-2-yl)methyl]aniline Openeye Name: 3-chloro-4-methyl-N-[(5-nitro-2-furyl)methyl]aniline CAS Name: 3-chloro-4-methyl-N-[(5-nitro-2-furanyl)methyl]aniline IUPAC Name: 3-chloro-4-methyl-N-[(5-nitrofuran-2-yl)methyl]aniline Traditional Name: (3-chloro-4-methyl-phenyl)-[(5-nitro-2-furyl)methyl]amine Formula: C12H11ClN2O3 MolecularWeight: 266.68034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC=C(O2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC=C(O2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H11ClN2O3/c1-8-2-3-9(6-11(8)13)14-7-10-4-5-12(18-10)15(16)17/h2-6,14H,7H2,1H3