(6E)-2-azanyl-6-[2-[(5-methyl-1,2-oxazol-3-yl)methoxy]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carbonitrile

Systemtic Name: (6E)-2-azanyl-6-[2-[(5-methyl-1,2-oxazol-3-yl)methoxy]-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carbonitrile Openeye Name: (6E)-2-amino-6-[2-[(5-methylisoxazol-3-yl)methoxy]-6-oxo-cyclohexa-2,4-dien-1-ylidene]-4-(3-piperidyl)-1H-pyridine-3-carbonitrile CAS Name: (6E)-2-amino-6-[2-[(5-methyl-3-isoxazolyl)methoxy]-6-oxo-1-cyclohexa-2,4-dienylidene]-4-(3-piperidinyl)-1H-pyridine-3-carbonitrile IUPAC Name: (6E)-2-amino-6-[2-[(5-methyl-1,2-oxazol-3-yl)methoxy]-6-oxocyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carbonitrile Traditional Name: (6E)-2-amino-6-[6-keto-2-[(5-methylisoxazol-3-yl)methoxy]cyclohexa-2,4-dien-1-ylidene]-4-(3-piperidyl)-1H-pyridine-3-carbonitrile Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC2=CC=CC(=O)C2=C3C=C(C(=C(N3)N)C#N)C4CCCNC4

Isomeric SMILES

CC1=CC(=NO1)COC\2=CC=CC(=O)/C2=C/3\C=C(C(=C(N3)N)C#N)C4CCCNC4

InChI

InChI=1S/C22H23N5O3/c1-13-8-15(27-30-13)12-29-20-6-2-5-19(28)21(20)18-9-16(14-4-3-7-25-11-14)17(10-23)22(24)26-18/h2,5-6,8-9,14,25-26H,3-4,7,11-12,24H2,1H3/b21-18-