methyl 4-[[(4-oxidanylidenechromen-3-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-oxidanylidenechromen-3-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Openeye Name: methyl 4-[[(4-oxochromen-3-yl)methyl-(tetrahydrofuran-2-ylmethyl)amino]methyl]benzoate CAS Name: 4-[[(4-oxo-1-benzopyran-3-yl)methyl-(2-oxolanylmethyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-oxochromen-3-yl)methyl-(oxolan-2-ylmethyl)amino]methyl]benzoate Traditional Name: 4-[[(4-ketochromen-3-yl)methyl-(tetrahydrofurfuryl)amino]methyl]benzoic acid methyl ester Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CC2CCCO2)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CC2CCCO2)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25NO5/c1-28-24(27)18-10-8-17(9-11-18)13-25(15-20-5-4-12-29-20)14-19-16-30-22-7-3-2-6-21(22)23(19)26/h2-3,6-11,16,20H,4-5,12-15H2,1H3