methyl 4-[(8-butyl-9-oxidanylidene-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoate

Systemtic Name: methyl 4-[(8-butyl-9-oxidanylidene-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoate Openeye Name: methyl 4-[(8-butyl-9-oxo-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoate CAS Name: 4-[(8-butyl-9-oxo-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(8-butyl-9-oxo-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoate Traditional Name: 4-[(8-butyl-9-keto-7,8-diazaspiro[4.4]non-6-en-6-yl)oxymethyl]benzoic acid methyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2(CCCC2)C(=N1)OCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCN1C(=O)C2(CCCC2)C(=N1)OCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H26N2O4/c1-3-4-13-22-19(24)20(11-5-6-12-20)18(21-22)26-14-15-7-9-16(10-8-15)17(23)25-2/h7-10H,3-6,11-14H2,1-2H3