methyl (1S)-8-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate

Systemtic Name: methyl (1S)-8-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Openeye Name: methyl (1S)-4-allyl-8-[(5-methyl-2-furyl)methyl]-3-oxo-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate CAS Name: (1S)-8-[(5-methyl-2-furanyl)methyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-8-[(5-methylfuran-2-yl)methyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Traditional Name: (1S)-4-allyl-3-keto-8-[(5-methyl-2-furyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C19H27N2O4+ MolecularWeight: 347.42868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC3(CC2)C(CC(=O)N3CC=C)C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC3(CC2)[C@H](CC(=O)N3CC=C)C(=O)OC

InChI

InChI=1S/C19H26N2O4/c1-4-9-21-17(22)12-16(18(23)24-3)19(21)7-10-20(11-8-19)13-15-6-5-14(2)25-15/h4-6,16H,1,7-13H2,2-3H3/p+1/t16-/m1/s1