2-chloranyl-3-[4-(phenylmethyl)piperidin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[4-(phenylmethyl)piperidin-1-yl]naphthalene-1,4-dione Openeye Name: 2-(4-benzyl-1-piperidyl)-3-chloro-naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-(phenylmethyl)-1-piperidinyl]naphthalene-1,4-dione IUPAC Name: 2-(4-benzylpiperidin-1-yl)-3-chloronaphthalene-1,4-dione Traditional Name: 2-(4-benzylpiperidino)-3-chloro-1,4-naphthoquinone Formula: C22H20ClNO2 MolecularWeight: 365.8527

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C22H20ClNO2/c23-19-20(22(26)18-9-5-4-8-17(18)21(19)25)24-12-10-16(11-13-24)14-15-6-2-1-3-7-15/h1-9,16H,10-14H2