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

Systemtic Name: [(2S)-2-(3-cyclopentyloxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]-(2-methylpropyl)azanium Openeye Name: [(2S)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-hydroxy-ethyl]-isobutyl-ammonium CAS Name: [(2S)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-hydroxyethyl]-(2-methylpropyl)ammonium IUPAC Name: [(2S)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-hydroxyethyl]-(2-methylpropyl)azanium Traditional Name: [(2S)-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-hydroxy-ethyl]-isobutyl-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/c1-13(2)11-19-12-16(20)14-8-9-17(21-3)18(10-14)22-15-6-4-5-7-15/h8-10,13,15-16,19-20H,4-7,11-12H2,1-3H3/p+1/t16-/m1/s1