ethyl 2-ethoxy-3-[4-[2-(4-methyl-7-oxidanylidene-1,4-diazepan-1-yl)ethoxy]phenyl]propanoate

Systemtic Name: ethyl 2-ethoxy-3-[4-[2-(4-methyl-7-oxidanylidene-1,4-diazepan-1-yl)ethoxy]phenyl]propanoate Openeye Name: ethyl 2-ethoxy-3-[4-[2-(4-methyl-7-oxo-1,4-diazepan-1-yl)ethoxy]phenyl]propanoate CAS Name: 2-ethoxy-3-[4-[2-(4-methyl-7-oxo-1,4-diazepan-1-yl)ethoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-3-[4-[2-(4-methyl-7-oxo-1,4-diazepan-1-yl)ethoxy]phenyl]propanoate Traditional Name: 2-ethoxy-3-[4-[2-(7-keto-4-methyl-1,4-diazepan-1-yl)ethoxy]phenyl]propionic acid ethyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2CCN(CCC2=O)C)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2CCN(CCC2=O)C)C(=O)OCC

InChI

InChI=1S/C21H32N2O5/c1-4-26-19(21(25)27-5-2)16-17-6-8-18(9-7-17)28-15-14-23-13-12-22(3)11-10-20(23)24/h6-9,19H,4-5,10-16H2,1-3H3