(Z)-2-(3-azanyloxypropyl)-3-(1-imidazol-1-yl-2-phenyl-ethyl)hex-2-enoic acid

Systemtic Name: (Z)-2-(3-azanyloxypropyl)-3-(1-imidazol-1-yl-2-phenyl-ethyl)hex-2-enoic acid Openeye Name: (Z)-2-(3-aminooxypropyl)-3-(1-imidazol-1-yl-2-phenyl-ethyl)hex-2-enoic acid CAS Name: (Z)-2-(3-aminooxypropyl)-3-[1-(1-imidazolyl)-2-phenylethyl]-2-hexenoic acid IUPAC Name: (Z)-2-(3-aminooxypropyl)-3-(1-imidazol-1-yl-2-phenylethyl)hex-2-enoic acid Traditional Name: (Z)-2-(3-aminooxypropyl)-3-(1-imidazol-1-yl-2-phenyl-ethyl)hex-2-enoic acid Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(CCCON)C(=O)O)C(CC1=CC=CC=C1)N2C=CN=C2

Isomeric SMILES

CCC/C(=C(\CCCON)/C(=O)O)/C(CC1=CC=CC=C1)N2C=CN=C2

InChI

InChI=1S/C20H27N3O3/c1-2-7-17(18(20(24)25)10-6-13-26-21)19(23-12-11-22-15-23)14-16-8-4-3-5-9-16/h3-5,8-9,11-12,15,19H,2,6-7,10,13-14,21H2,1H3,(H,24,25)/b18-17-