tert-butyl-[(2S)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]ammonium Formula: C17H28NO3+ MolecularWeight: 294.40912

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCC(C[NH2+]C(C)(C)C)O)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO3/c1-6-7-13-8-9-15(16(10-13)20-5)21-12-14(19)11-18-17(2,3)4/h6-10,14,18-19H,11-12H2,1-5H3/p+1/b7-6+/t14-/m0/s1