N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]piperidin-1-ium-4-carbohydrazide

Systemtic Name: N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]piperidin-1-ium-4-carbohydrazide Openeye Name: 1-[(2S)-3-benzyloxy-2-hydroxy-propyl]-N'-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]piperidin-1-ium-4-carbohydrazide CAS Name: 1-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-N'-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-piperidin-1-iumcarbohydrazide IUPAC Name: 1-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-N'-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]piperidin-1-ium-4-carbohydrazide Traditional Name: 1-[(2S)-3-benzoxy-2-hydroxy-propyl]-N'-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]piperidin-1-ium-4-carbohydrazide Formula: C24H32N3O5+ MolecularWeight: 442.52798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2CC[NH+](CC2)CC(COCC3=CC=CC=C3)O)C=CC1=O

Isomeric SMILES

COC1=CC(=CNNC(=O)C2CC[NH+](CC2)C[C@@H](COCC3=CC=CC=C3)O)C=CC1=O

InChI

InChI=1S/C24H31N3O5/c1-31-23-13-19(7-8-22(23)29)14-25-26-24(30)20-9-11-27(12-10-20)15-21(28)17-32-16-18-5-3-2-4-6-18/h2-8,13-14,20-21,25,28H,9-12,15-17H2,1H3,(H,26,30)/p+1/t21-/m0/s1