5-azanyl-2-methyl-8-[(5-methyl-2-nitro-phenyl)amino]octan-4-ol

Systemtic Name: 5-azanyl-2-methyl-8-[(5-methyl-2-nitro-phenyl)amino]octan-4-ol Openeye Name: 5-amino-2-methyl-8-(5-methyl-2-nitro-anilino)octan-4-ol CAS Name: 5-amino-2-methyl-8-(5-methyl-2-nitroanilino)-4-octanol IUPAC Name: 5-amino-2-methyl-8-(5-methyl-2-nitroanilino)octan-4-ol Traditional Name: 5-amino-2-methyl-8-(5-methyl-2-nitro-anilino)octan-4-ol Formula: C16H27N3O3 MolecularWeight: 309.40388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O3/c1-11(2)9-16(20)13(17)5-4-8-18-14-10-12(3)6-7-15(14)19(21)22/h6-7,10-11,13,16,18,20H,4-5,8-9,17H2,1-3H3