tert-butyl-[(2S)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]azanium Openeye Name: tert-butyl-[(2S)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-hydroxy-ethyl]ammonium CAS Name: tert-butyl-[(2S)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-hydroxyethyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-hydroxyethyl]azanium Traditional Name: tert-butyl-[(2S)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-hydroxy-ethyl]ammonium Formula: C18H30NO3+ MolecularWeight: 308.4357

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(C1=CC(=C(C=C1)OC)OC2CCCC2)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](C1=CC(=C(C=C1)OC)OC2CCCC2)O

InChI

InChI=1S/C18H29NO3/c1-18(2,3)19-12-15(20)13-9-10-16(21-4)17(11-13)22-14-7-5-6-8-14/h9-11,14-15,19-20H,5-8,12H2,1-4H3/p+1/t15-/m1/s1