methyl (1S)-4-methyl-3-oxidanylidene-8-[(3-phenoxyphenyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate

Systemtic Name: methyl (1S)-4-methyl-3-oxidanylidene-8-[(3-phenoxyphenyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Openeye Name: methyl (1S)-4-methyl-3-oxo-8-[(3-phenoxyphenyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate CAS Name: (1S)-4-methyl-3-oxo-8-[(3-phenoxyphenyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester IUPAC Name: methyl (1S)-4-methyl-3-oxo-8-[(3-phenoxyphenyl)methyl]-4-aza-8-azoniaspiro[4.5]decane-1-carboxylate Traditional Name: (1S)-3-keto-4-methyl-8-(3-phenoxybenzyl)-4-aza-8-azoniaspiro[4.5]decane-1-carboxylic acid methyl ester Formula: C24H29N2O4+ MolecularWeight: 409.49806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(C12CC[NH+](CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CN1C(=O)C[C@@H](C12CC[NH+](CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H28N2O4/c1-25-22(27)16-21(23(28)29-2)24(25)11-13-26(14-12-24)17-18-7-6-10-20(15-18)30-19-8-4-3-5-9-19/h3-10,15,21H,11-14,16-17H2,1-2H3/p+1/t21-/m1/s1