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

Systemtic Name: cyclopropyl-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-oxidanyl-ethyl]azanium Openeye Name: cyclopropyl-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-hydroxy-ethyl]ammonium CAS Name: cyclopropyl-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-hydroxyethyl]ammonium IUPAC Name: cyclopropyl-[(2S)-2-(4-ethoxy-3-methoxyphenyl)-2-hydroxyethyl]azanium Traditional Name: cyclopropyl-[(2S)-2-(4-ethoxy-3-methoxy-phenyl)-2-hydroxy-ethyl]ammonium Formula: C14H22NO3+ MolecularWeight: 252.32938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C[NH2+]C2CC2)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H](C[NH2+]C2CC2)O)OC

InChI

InChI=1S/C14H21NO3/c1-3-18-13-7-4-10(8-14(13)17-2)12(16)9-15-11-5-6-11/h4,7-8,11-12,15-16H,3,5-6,9H2,1-2H3/p+1/t12-/m1/s1