2-[(3-methyl-4-nitro-phenyl)amino]butan-1-ol

Systemtic Name: 2-[(3-methyl-4-nitro-phenyl)amino]butan-1-ol Openeye Name: 2-(3-methyl-4-nitro-anilino)butan-1-ol CAS Name: 2-(3-methyl-4-nitroanilino)-1-butanol IUPAC Name: 2-(3-methyl-4-nitroanilino)butan-1-ol Traditional Name: 2-(3-methyl-4-nitro-anilino)butan-1-ol Formula: C11H16N2O3 MolecularWeight: 224.25634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=CC(=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCC(CO)NC1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C11H16N2O3/c1-3-9(7-14)12-10-4-5-11(13(15)16)8(2)6-10/h4-6,9,12,14H,3,7H2,1-2H3