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

Systemtic Name: [(2S)-2-(4-cyclopentyloxy-3-methoxy-phenyl)-2-oxidanyl-ethyl]-cyclopropyl-azanium Openeye Name: [(2S)-2-[4-(cyclopentoxy)-3-methoxy-phenyl]-2-hydroxy-ethyl]-cyclopropyl-ammonium CAS Name: [(2S)-2-(4-cyclopentyloxy-3-methoxyphenyl)-2-hydroxyethyl]-cyclopropylammonium IUPAC Name: [(2S)-2-(4-cyclopentyloxy-3-methoxyphenyl)-2-hydroxyethyl]-cyclopropylazanium Traditional Name: [(2S)-2-[4-(cyclopentoxy)-3-methoxy-phenyl]-2-hydroxy-ethyl]-cyclopropyl-ammonium Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C[NH2+]C2CC2)O)OC3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[C@@H](C[NH2+]C2CC2)O)OC3CCCC3

InChI

InChI=1S/C17H25NO3/c1-20-17-10-12(15(19)11-18-13-7-8-13)6-9-16(17)21-14-4-2-3-5-14/h6,9-10,13-15,18-19H,2-5,7-8,11H2,1H3/p+1/t15-/m1/s1