(6E)-2-bromanyl-4-(phenylmethyl)-6-[[(2-piperidin-1-ylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-bromanyl-4-(phenylmethyl)-6-[[(2-piperidin-1-ylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-benzyl-2-bromo-6-[[2-(1-piperidyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-bromo-4-(phenylmethyl)-6-[[2-(1-piperidinyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-benzyl-2-bromo-6-[(2-piperidin-1-ylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-benzyl-2-bromo-6-[(2-piperidinoanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C25H25BrN2O MolecularWeight: 449.3828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2NC=C3C=C(C=C(C3=O)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2N/C=C/3\C=C(C=C(C3=O)Br)CC4=CC=CC=C4

InChI

InChI=1S/C25H25BrN2O/c26-22-17-20(15-19-9-3-1-4-10-19)16-21(25(22)29)18-27-23-11-5-6-12-24(23)28-13-7-2-8-14-28/h1,3-6,9-12,16-18,27H,2,7-8,13-15H2/b21-18+