2-chloranyl-3-[methyl-(3-phenyl-3-pyridin-2-yl-propyl)amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[methyl-(3-phenyl-3-pyridin-2-yl-propyl)amino]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[methyl-[3-phenyl-3-(2-pyridyl)propyl]amino]naphthalene-1,4-dione CAS Name: 2-chloro-3-[methyl-[3-phenyl-3-(2-pyridinyl)propyl]amino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[methyl-(3-phenyl-3-pyridin-2-ylpropyl)amino]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[methyl-[3-phenyl-3-(2-pyridyl)propyl]amino]-1,4-naphthoquinone Formula: C25H21ClN2O2 MolecularWeight: 416.89944

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(C1=CC=CC=C1)C2=CC=CC=N2)C3=C(C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CN(CCC(C1=CC=CC=C1)C2=CC=CC=N2)C3=C(C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C25H21ClN2O2/c1-28(23-22(26)24(29)19-11-5-6-12-20(19)25(23)30)16-14-18(17-9-3-2-4-10-17)21-13-7-8-15-27-21/h2-13,15,18H,14,16H2,1H3