(E)-2-azanyl-5-[(5-methyl-2-nitro-phenyl)amino]pent-3-en-1-ol

Systemtic Name: (E)-2-azanyl-5-[(5-methyl-2-nitro-phenyl)amino]pent-3-en-1-ol Openeye Name: (E)-2-amino-5-(5-methyl-2-nitro-anilino)pent-3-en-1-ol CAS Name: (E)-2-amino-5-(5-methyl-2-nitroanilino)-3-penten-1-ol IUPAC Name: (E)-2-amino-5-(5-methyl-2-nitroanilino)pent-3-en-1-ol Traditional Name: (E)-2-amino-5-(5-methyl-2-nitro-anilino)pent-3-en-1-ol Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3/c1-9-4-5-12(15(17)18)11(7-9)14-6-2-3-10(13)8-16/h2-5,7,10,14,16H,6,8,13H2,1H3/b3-2+