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9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid

9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid

Systemtic Name:9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid
Openeye Name:9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid
CAS Name:9-[butoxy(oxo)methyl]-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid
IUPAC Name:9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid
Traditional Name:9-butoxycarbonyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-1-carboxylic acid
Formula: C15H21NO4
MolecularWeight: 279.33154
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CCCCN2C1=C(C=C2)C(=O)O


Isomeric SMILES

CCCCOC(=O)C1CCCCN2C1=C(C=C2)C(=O)O


InChI

InChI=1S/C15H21NO4/c1-2-3-10-20-15(19)12-6-4-5-8-16-9-7-11(13(12)16)14(17)18/h7,9,12H,2-6,8,10H2,1H3,(H,17,18)


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