[2-[[2-azanylidene-7-(2-hydroxyethyl)azepan-1-yl]methoxy]phenyl] ethanoate

Systemtic Name: [2-[[2-azanylidene-7-(2-hydroxyethyl)azepan-1-yl]methoxy]phenyl] ethanoate Openeye Name: [2-[[2-(2-hydroxyethyl)-7-imino-azepan-1-yl]methoxy]phenyl] acetate CAS Name: acetic acid [2-[[2-(2-hydroxyethyl)-7-imino-1-azepanyl]methoxy]phenyl] ester IUPAC Name: [2-[[2-(2-hydroxyethyl)-7-iminoazepan-1-yl]methoxy]phenyl] acetate Traditional Name: acetic acid [2-[[2-(2-hydroxyethyl)-7-imino-azepan-1-yl]methoxy]phenyl] ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1OCN2C(CCCCC2=N)CCO

Isomeric SMILES

CC(=O)OC1=CC=CC=C1OCN2C(CCCCC2=N)CCO

InChI

InChI=1S/C17H24N2O4/c1-13(21)23-16-8-4-3-7-15(16)22-12-19-14(10-11-20)6-2-5-9-17(19)18/h3-4,7-8,14,18,20H,2,5-6,9-12H2,1H3