3-azanylpropane-1,2-diol; 3-methyl-4-nitro-aniline

Systemtic Name: 3-azanylpropane-1,2-diol; 3-methyl-4-nitro-aniline Openeye Name: 3-aminopropane-1,2-diol; 3-methyl-4-nitro-aniline CAS Name: 3-aminopropane-1,2-diol; 3-methyl-4-nitroaniline IUPAC Name: 3-aminopropane-1,2-diol; 3-methyl-4-nitroaniline Traditional Name: 3-aminopropane-1,2-diol; (3-methyl-4-nitro-phenyl)amine Formula: C10H17N3O4 MolecularWeight: 243.25968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8N2O2.C3H9NO2/c1-5-4-6(8)2-3-7(5)9(10)11;4-1-3(6)2-5/h2-4H,8H2,1H3;3,5-6H,1-2,4H2