(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)CNC(=O)NC(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)CNC(=O)NC(C)C

InChI

InChI=1S/C24H26N2O5/c1-4-16-7-10-20-19(12-22(27)31-21(20)11-16)14-30-23(28)18-8-5-17(6-9-18)13-25-24(29)26-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H2,25,26,29)