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11-[1-(2-carboxyethyl)piperidin-4-ylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid

11-[1-(2-carboxyethyl)piperidin-4-ylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid

Systemtic Name:11-[1-(2-carboxyethyl)piperidin-4-ylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid
Openeye Name:11-[1-(2-carboxyethyl)-4-piperidylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid
CAS Name:11-[1-(2-carboxyethyl)-4-piperidinylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid
IUPAC Name:11-[1-(2-carboxyethyl)piperidin-4-ylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid
Traditional Name:11-[1-(2-carboxyethyl)-4-piperidylidene]-5H-[1]benzoxepino[4,3-b]pyridine-9-carboxylic acid
Formula: C22H22N2O5
MolecularWeight: 394.42048
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=C2C3=C(C=CC(=C3)C(=O)O)OCC4=C2N=CC=C4)CCC(=O)O


Isomeric SMILES

C1CN(CCC1=C2C3=C(C=CC(=C3)C(=O)O)OCC4=C2N=CC=C4)CCC(=O)O


InChI

InChI=1S/C22H22N2O5/c25-19(26)7-11-24-9-5-14(6-10-24)20-17-12-15(22(27)28)3-4-18(17)29-13-16-2-1-8-23-21(16)20/h1-4,8,12H,5-7,9-11,13H2,(H,25,26)(H,27,28)


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