3-(furan-3-ylcarbonyl)-6-methyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid

Systemtic Name: 3-(furan-3-ylcarbonyl)-6-methyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid Openeye Name: 3-(furan-3-carbonyl)-6-methyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid CAS Name: 3-[3-furanyl(oxo)methyl]-6-methyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid IUPAC Name: 3-(furan-3-carbonyl)-6-methyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid Traditional Name: 3-(3-furoyl)-6-methyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-9-carboxylic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2=CC=C(N2C1)C(=O)C3=COC=C3)C(=O)O

Isomeric SMILES

CC1CCC(C2=CC=C(N2C1)C(=O)C3=COC=C3)C(=O)O

InChI

InChI=1S/C16H17NO4/c1-10-2-3-12(16(19)20)13-4-5-14(17(13)8-10)15(18)11-6-7-21-9-11/h4-7,9-10,12H,2-3,8H2,1H3,(H,19,20)