4-[4-[(2S,4R)-6-oxidanylidene-4-phenyl-oxan-2-yl]butyl]benzenecarboximidamide

Systemtic Name: 4-[4-[(2S,4R)-6-oxidanylidene-4-phenyl-oxan-2-yl]butyl]benzenecarboximidamide Openeye Name: 4-[4-[(2S,4R)-6-oxo-4-phenyl-tetrahydropyran-2-yl]butyl]benzamidine CAS Name: 4-[4-[(2S,4R)-6-oxo-4-phenyl-2-oxanyl]butyl]benzenecarboximidamide IUPAC Name: 4-[4-[(2S,4R)-6-oxo-4-phenyloxan-2-yl]butyl]benzenecarboximidamide Traditional Name: 4-[4-[(2S,4R)-6-keto-4-phenyl-tetrahydropyran-2-yl]butyl]benzamidine Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)OC1CCCCC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3

Isomeric SMILES

C1[C@H](CC(=O)O[C@H]1CCCCC2=CC=C(C=C2)C(=N)N)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c23-22(24)18-12-10-16(11-13-18)6-4-5-9-20-14-19(15-21(25)26-20)17-7-2-1-3-8-17/h1-3,7-8,10-13,19-20H,4-6,9,14-15H2,(H3,23,24)/t19-,20+/m1/s1