propan-2-yl 3-(furan-3-ylcarbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylate

Systemtic Name: propan-2-yl 3-(furan-3-ylcarbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylate Openeye Name: isopropyl 3-(furan-3-carbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylate CAS Name: 3-[3-furanyl(oxo)methyl]-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(furan-3-carbonyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-9-carboxylate Traditional Name: 3-(3-furoyl)-2-propyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-9-carboxylic acid isopropyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N2CCCCC(C2=C1)C(=O)OC(C)C)C(=O)C3=COC=C3

Isomeric SMILES

CCCC1=C(N2CCCCC(C2=C1)C(=O)OC(C)C)C(=O)C3=COC=C3

InChI

InChI=1S/C21H27NO4/c1-4-7-15-12-18-17(21(24)26-14(2)3)8-5-6-10-22(18)19(15)20(23)16-9-11-25-13-16/h9,11-14,17H,4-8,10H2,1-3H3