cyclopentyl-[(6-ethoxy-2-oxidanylidene-chromen-4-yl)methyl]-(furan-2-ylmethyl)azanium

Systemtic Name: cyclopentyl-[(6-ethoxy-2-oxidanylidene-chromen-4-yl)methyl]-(furan-2-ylmethyl)azanium Openeye Name: cyclopentyl-[(6-ethoxy-2-oxo-chromen-4-yl)methyl]-(2-furylmethyl)ammonium CAS Name: cyclopentyl-[(6-ethoxy-2-oxo-1-benzopyran-4-yl)methyl]-(2-furanylmethyl)ammonium IUPAC Name: cyclopentyl-[(6-ethoxy-2-oxochromen-4-yl)methyl]-(furan-2-ylmethyl)azanium Traditional Name: cyclopentyl-[(6-ethoxy-2-keto-chromen-4-yl)methyl]-(2-furfuryl)ammonium Formula: C22H26NO4+ MolecularWeight: 368.44614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2C[NH+](CC3=CC=CO3)C4CCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2C[NH+](CC3=CC=CO3)C4CCCC4

InChI

InChI=1S/C22H25NO4/c1-2-25-18-9-10-21-20(13-18)16(12-22(24)27-21)14-23(17-6-3-4-7-17)15-19-8-5-11-26-19/h5,8-13,17H,2-4,6-7,14-15H2,1H3/p+1