(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-phenoxyethyl)azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-phenoxyethyl)azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-(2-phenoxyethyl)ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-(2-phenoxyethyl)ammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-(2-phenoxyethyl)azanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-(2-phenoxyethyl)ammonium Formula: C20H22NO3+ MolecularWeight: 324.39358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCOC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCOC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3/c1-2-15-8-9-18-16(13-20(22)24-19(18)12-15)14-21-10-11-23-17-6-4-3-5-7-17/h3-9,12-13,21H,2,10-11,14H2,1H3/p+1