(6E)-2-azanyl-6-[2-(cyclopropylmethoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carboxylic acid

Systemtic Name: (6E)-2-azanyl-6-[2-(cyclopropylmethoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carboxylic acid Openeye Name: (6E)-2-amino-6-[2-(cyclopropylmethoxy)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-4-(3-piperidyl)-1H-pyridine-3-carboxylic acid CAS Name: (6E)-2-amino-6-[2-(cyclopropylmethoxy)-6-oxo-1-cyclohexa-2,4-dienylidene]-4-(3-piperidinyl)-1H-pyridine-3-carboxylic acid IUPAC Name: (6E)-2-amino-6-[2-(cyclopropylmethoxy)-6-oxocyclohexa-2,4-dien-1-ylidene]-4-piperidin-3-yl-1H-pyridine-3-carboxylic acid Traditional Name: (6E)-2-amino-6-[2-(cyclopropylmethoxy)-6-keto-cyclohexa-2,4-dien-1-ylidene]-4-(3-piperidyl)-1H-pyridine-3-carboxylic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=CC(=C3C(=O)C=CC=C3OCC4CC4)NC(=C2C(=O)O)N

Isomeric SMILES

C1CC(CNC1)C2=C/C(=C/3\C(=O)C=CC=C3OCC4CC4)/NC(=C2C(=O)O)N

InChI

InChI=1S/C21H25N3O4/c22-20-18(21(26)27)14(13-3-2-8-23-10-13)9-15(24-20)19-16(25)4-1-5-17(19)28-11-12-6-7-12/h1,4-5,9,12-13,23-24H,2-3,6-8,10-11,22H2,(H,26,27)/b19-15-