[4-[3-(azepan-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl] ethanoate

Systemtic Name: [4-[3-(azepan-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl] ethanoate Openeye Name: [4-[3-(azepan-1-yl)-2,5-dioxo-pyrrolidin-1-yl]phenyl] acetate CAS Name: acetic acid [4-[3-(1-azepanyl)-2,5-dioxo-1-pyrrolidinyl]phenyl] ester IUPAC Name: [4-[3-(azepan-1-yl)-2,5-dioxopyrrolidin-1-yl]phenyl] acetate Traditional Name: acetic acid [4-[3-(azepan-1-yl)-2,5-diketo-pyrrolidino]phenyl] ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCCCCC3

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCCCCC3

InChI

InChI=1S/C18H22N2O4/c1-13(21)24-15-8-6-14(7-9-15)20-17(22)12-16(18(20)23)19-10-4-2-3-5-11-19/h6-9,16H,2-5,10-12H2,1H3