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

Systemtic Name: methyl (1S)-8-[(E)-2-methylbut-2-enyl]-3-oxidanylidene-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Openeye Name: methyl (1S)-4-allyl-8-[(E)-2-methylbut-2-enyl]-3-oxo-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate CAS Name: (1S)-8-[(E)-2-methylbut-2-enyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-8-[(E)-2-methylbut-2-enyl]-3-oxo-4-prop-2-enyl-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Traditional Name: (1S)-4-allyl-3-keto-8-[(E)-2-methylbut-2-enyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCC2(CC1)C(CC(=O)N2CC=C)C(=O)OC

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC2(CC1)[C@H](CC(=O)N2CC=C)C(=O)OC

InChI

InChI=1S/C18H28N2O3/c1-5-9-20-16(21)12-15(17(22)23-4)18(20)7-10-19(11-8-18)13-14(3)6-2/h5-6,15H,1,7-13H2,2-4H3/p+1/b14-6+/t15-/m1/s1