hexadecan-1-amine; 2-(4-hydroxyphenyl)isoindole-1,3-dione

Systemtic Name: hexadecan-1-amine; 2-(4-hydroxyphenyl)isoindole-1,3-dione Openeye Name: hexadecan-1-amine; 2-(4-hydroxyphenyl)isoindoline-1,3-dione CAS Name: 1-hexadecanamine; 2-(4-hydroxyphenyl)isoindole-1,3-dione IUPAC Name: hexadecan-1-amine; 2-(4-hydroxyphenyl)isoindole-1,3-dione Traditional Name: cetylamine; 2-(4-hydroxyphenyl)isoindoline-1,3-quinone Formula: C30H44N2O3 MolecularWeight: 480.68196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN.C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCCCCCCCCCCCCCN.C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C16H35N.C14H9NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;16-10-7-5-9(6-8-10)15-13(17)11-3-1-2-4-12(11)14(15)18/h2-17H2,1H3;1-8,16H