methyl 8-[(4-fluoranyl-3-methoxy-phenyl)methyl]-3-oxidanylidene-4-prop-2-enyl-4,8-diazaspiro[4.5]decane-1-carboxylate

Systemtic Name: methyl 8-[(4-fluoranyl-3-methoxy-phenyl)methyl]-3-oxidanylidene-4-prop-2-enyl-4,8-diazaspiro[4.5]decane-1-carboxylate Openeye Name: methyl 4-allyl-8-[(4-fluoro-3-methoxy-phenyl)methyl]-3-oxo-4,8-diazaspiro[4.5]decane-1-carboxylate CAS Name: 8-[(4-fluoro-3-methoxyphenyl)methyl]-3-oxo-4-prop-2-enyl-4,8-diazaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl 8-[(4-fluoro-3-methoxyphenyl)methyl]-3-oxo-4-prop-2-enyl-4,8-diazaspiro[4.5]decane-1-carboxylate Traditional Name: 4-allyl-8-(4-fluoro-3-methoxy-benzyl)-3-keto-4,8-diazaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C21H27FN2O4 MolecularWeight: 390.448483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCC3(CC2)C(CC(=O)N3CC=C)C(=O)OC)F

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCC3(CC2)C(CC(=O)N3CC=C)C(=O)OC)F

InChI

InChI=1S/C21H27FN2O4/c1-4-9-24-19(25)13-16(20(26)28-3)21(24)7-10-23(11-8-21)14-15-5-6-17(22)18(12-15)27-2/h4-6,12,16H,1,7-11,13-14H2,2-3H3