2-[(4-octoxyphenyl)amino]-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-[(4-octoxyphenyl)amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(4-octoxyanilino)-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-(4-octoxyanilino)-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-octoxyanilino)-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(4-octoxyanilino)-3-piperidino-1,4-naphthoquinone Formula: C29H36N2O3 MolecularWeight: 460.60774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C29H36N2O3/c1-2-3-4-5-6-12-21-34-23-17-15-22(16-18-23)30-26-27(31-19-10-7-11-20-31)29(33)25-14-9-8-13-24(25)28(26)32/h8-9,13-18,30H,2-7,10-12,19-21H2,1H3