2-pentadecyl-3-(phenylazanylmethyl)naphthalene-1,4-dione

Systemtic Name: 2-pentadecyl-3-(phenylazanylmethyl)naphthalene-1,4-dione Openeye Name: 2-(anilinomethyl)-3-pentadecyl-naphthalene-1,4-dione CAS Name: 2-(anilinomethyl)-3-pentadecylnaphthalene-1,4-dione IUPAC Name: 2-(anilinomethyl)-3-pentadecylnaphthalene-1,4-dione Traditional Name: 2-(anilinomethyl)-3-pentadecyl-1,4-naphthoquinone Formula: C32H43NO2 MolecularWeight: 473.68932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CNC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CNC3=CC=CC=C3

InChI

InChI=1S/C32H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-22-29-30(25-33-26-20-15-14-16-21-26)32(35)28-24-19-18-23-27(28)31(29)34/h14-16,18-21,23-24,33H,2-13,17,22,25H2,1H3