3-(5-methylfuran-2-yl)carbonyl-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid

Systemtic Name: 3-(5-methylfuran-2-yl)carbonyl-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid Openeye Name: 3-(5-methylfuran-2-carbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid CAS Name: 3-[(5-methyl-2-furanyl)-oxomethyl]-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid IUPAC Name: 3-(5-methylfuran-2-carbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid Traditional Name: 3-(5-methyl-2-furoyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-9-carboxylic acid Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N2CCCCC(C2=C1)C(=O)O)C(=O)C3=CC=C(O3)C

Isomeric SMILES

CCCC1=C(N2CCCCC(C2=C1)C(=O)O)C(=O)C3=CC=C(O3)C

InChI

InChI=1S/C19H23NO4/c1-3-6-13-11-15-14(19(22)23)7-4-5-10-20(15)17(13)18(21)16-9-8-12(2)24-16/h8-9,11,14H,3-7,10H2,1-2H3,(H,22,23)