cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]azanium Openeye Name: cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]ammonium CAS Name: cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]ammonium IUPAC Name: cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]azanium Traditional Name: cycloheptyl-[(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]ammonium Formula: C17H28NO3+ MolecularWeight: 294.40912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C[NH2+]C2CCCCCC2)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](C[NH2+]C2CCCCCC2)O)OC

InChI

InChI=1S/C17H27NO3/c1-20-16-10-9-13(11-17(16)21-2)15(19)12-18-14-7-5-3-4-6-8-14/h9-11,14-15,18-19H,3-8,12H2,1-2H3/p+1/t15-/m1/s1