azane; chloranylethane; 4-methyl-3-nitro-aniline

Systemtic Name: azane; chloranylethane; 4-methyl-3-nitro-aniline Openeye Name: ammonia; chloroethane; 4-methyl-3-nitro-aniline CAS Name: ammonia; chloroethane; 4-methyl-3-nitroaniline IUPAC Name: azane; chloroethane; 4-methyl-3-nitroaniline Traditional Name: ammonia; chloroethane; (4-methyl-3-nitro-phenyl)amine Formula: C9H16ClN3O2 MolecularWeight: 233.69524

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Descriptors Computed from Structure

Canonical SMILES:

CCCl.CC1=C(C=C(C=C1)N)[N+](=O)[O-].N

Isomeric SMILES

CCCl.CC1=C(C=C(C=C1)N)[N+](=O)[O-].N

InChI

InChI=1S/C7H8N2O2.C2H5Cl.H3N/c1-5-2-3-6(8)4-7(5)9(10)11;1-2-3;/h2-4H,8H2,1H3;2H2,1H3;1H3