3-azanyl-2-(6-heptoxyhexyl)-4-methyl-phenol

Systemtic Name: 3-azanyl-2-(6-heptoxyhexyl)-4-methyl-phenol Openeye Name: 3-amino-2-(6-heptoxyhexyl)-4-methyl-phenol CAS Name: 3-amino-2-(6-heptoxyhexyl)-4-methylphenol IUPAC Name: 3-amino-2-(6-heptoxyhexyl)-4-methylphenol Traditional Name: 3-amino-2-(6-heptoxyhexyl)-4-methyl-phenol Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCCCCCCC1=C(C=CC(=C1N)C)O

Isomeric SMILES

CCCCCCCOCCCCCCC1=C(C=CC(=C1N)C)O

InChI

InChI=1S/C20H35NO2/c1-3-4-5-7-10-15-23-16-11-8-6-9-12-18-19(22)14-13-17(2)20(18)21/h13-14,22H,3-12,15-16,21H2,1-2H3