(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-(3-phenylpropyl)azanium

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl-(3-phenylpropyl)azanium Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl-(3-phenylpropyl)ammonium CAS Name: (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl-(3-phenylpropyl)ammonium IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl-(3-phenylpropyl)azanium Traditional Name: (2-keto-7-methoxy-chromen-4-yl)methyl-(3-phenylpropyl)ammonium Formula: C20H22NO3+ MolecularWeight: 324.39358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCCC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3/c1-23-17-9-10-18-16(12-20(22)24-19(18)13-17)14-21-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13,21H,5,8,11,14H2,1H3/p+1