(4Z)-2-bromanyl-6-methoxy-4-[[[4-(pyridin-2-ylmethyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-2-bromanyl-6-methoxy-4-[[[4-(pyridin-2-ylmethyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-bromo-6-methoxy-4-[[[4-(2-pyridylmethyl)piperazin-1-yl]amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-bromo-6-methoxy-4-[[[4-(2-pyridinylmethyl)-1-piperazinyl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-bromo-6-methoxy-4-[[[4-(pyridin-2-ylmethyl)piperazin-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-bromo-6-methoxy-4-[[[4-(2-pyridylmethyl)piperazino]amino]methylene]cyclohexa-2,5-dien-1-one Formula: C18H21BrN4O2 MolecularWeight: 405.28894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2CCN(CC2)CC3=CC=CC=N3)C=C(C1=O)Br

Isomeric SMILES

COC1=C/C(=C/NN2CCN(CC2)CC3=CC=CC=N3)/C=C(C1=O)Br

InChI

InChI=1S/C18H21BrN4O2/c1-25-17-11-14(10-16(19)18(17)24)12-21-23-8-6-22(7-9-23)13-15-4-2-3-5-20-15/h2-5,10-12,21H,6-9,13H2,1H3/b14-12+