(6E)-6-[6-azanyl-5-(hydroxymethyl)-4-piperidin-3-yl-1H-pyridin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[6-azanyl-5-(hydroxymethyl)-4-piperidin-3-yl-1H-pyridin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[6-amino-5-(hydroxymethyl)-4-(3-piperidyl)-1H-pyridin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[6-amino-5-(hydroxymethyl)-4-(3-piperidinyl)-1H-pyridin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[6-amino-5-(hydroxymethyl)-4-piperidin-3-yl-1H-pyridin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[6-amino-5-methylol-4-(3-piperidyl)-1H-pyridin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=CC(=C3C=CC=CC3=O)NC(=C2CO)N

Isomeric SMILES

C1CC(CNC1)C2=C/C(=C\3/C=CC=CC3=O)/NC(=C2CO)N

InChI

InChI=1S/C17H21N3O2/c18-17-14(10-21)13(11-4-3-7-19-9-11)8-15(20-17)12-5-1-2-6-16(12)22/h1-2,5-6,8,11,19-21H,3-4,7,9-10,18H2/b15-12+