methyl 2-[2,7-bis(oxidanylidene)azepan-1-yl]ethanoate

Systemtic Name: methyl 2-[2,7-bis(oxidanylidene)azepan-1-yl]ethanoate Openeye Name: methyl 2-(2,7-dioxoazepan-1-yl)acetate CAS Name: 2-(2,7-dioxo-1-azepanyl)acetic acid methyl ester IUPAC Name: methyl 2-(2,7-dioxoazepan-1-yl)acetate Traditional Name: 2-(2,7-diketoazepan-1-yl)acetic acid methyl ester Formula: C9H13NO4 MolecularWeight: 199.20382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)CCCCC1=O

Isomeric SMILES

COC(=O)CN1C(=O)CCCCC1=O

InChI

InChI=1S/C9H13NO4/c1-14-9(13)6-10-7(11)4-2-3-5-8(10)12/h2-6H2,1H3