5-(phenylcarbonyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid

Systemtic Name: 5-(phenylcarbonyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid Openeye Name: 5-benzoyl-4-isopropyl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid CAS Name: 5-benzoyl-4-propan-2-yl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid IUPAC Name: 5-benzoyl-4-propan-2-yl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid Traditional Name: 5-benzoyl-4-isopropyl-2,3-dihydro-1H-pyrrolizin-4-ium-1-carboxylic acid Formula: C18H20NO3+ MolecularWeight: 298.3563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]12CCC(C1=CC=C2C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)[N+]12CCC(C1=CC=C2C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19NO3/c1-12(2)19-11-10-14(18(21)22)15(19)8-9-16(19)17(20)13-6-4-3-5-7-13/h3-9,12,14H,10-11H2,1-2H3/p+1