butyl 3-azanylidene-2-phenoxy-2-phenyl-propanoate; methanethiol; hydroiodide

Systemtic Name: butyl 3-azanylidene-2-phenoxy-2-phenyl-propanoate; methanethiol; hydroiodide Openeye Name: butyl 3-imino-2-phenoxy-2-phenyl-propanoate; methanethiol; hydroiodide CAS Name: 3-imino-2-phenoxy-2-phenylpropanoic acid butyl ester; methanethiol; hydroiodide IUPAC Name: butyl 3-imino-2-phenoxy-2-phenylpropanoate; methanethiol; hydroiodide Traditional Name: 3-imino-2-phenoxy-2-phenyl-propionic acid butyl ester; methanethiol; hydroiodide Formula: C20H26INO3S MolecularWeight: 487.39481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C=N)(C1=CC=CC=C1)OC2=CC=CC=C2.CS.I

Isomeric SMILES

CCCCOC(=O)C(C=N)(C1=CC=CC=C1)OC2=CC=CC=C2.CS.I

InChI

InChI=1S/C19H21NO3.CH4S.HI/c1-2-3-14-22-18(21)19(15-20,16-10-6-4-7-11-16)23-17-12-8-5-9-13-17;1-2;/h4-13,15,20H,2-3,14H2,1H3;2H,1H3;1H