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

Systemtic Name: 2-[(4-butoxyphenyl)amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(4-butoxyanilino)-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-(4-butoxyanilino)-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-butoxyanilino)-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(4-butoxyanilino)-3-piperidino-1,4-naphthoquinone Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C25H28N2O3/c1-2-3-17-30-19-13-11-18(12-14-19)26-22-23(27-15-7-4-8-16-27)25(29)21-10-6-5-9-20(21)24(22)28/h5-6,9-14,26H,2-4,7-8,15-17H2,1H3