1-[(3S,4S)-6-bromanyl-3-(hydroxymethyl)-3,4-dihydro-2H-chromen-4-yl]-1-methyl-3-phenyl-urea

Systemtic Name: 1-[(3S,4S)-6-bromanyl-3-(hydroxymethyl)-3,4-dihydro-2H-chromen-4-yl]-1-methyl-3-phenyl-urea Openeye Name: 1-[(3S,4S)-6-bromo-3-(hydroxymethyl)chroman-4-yl]-1-methyl-3-phenyl-urea CAS Name: 1-[(3S,4S)-6-bromo-3-(hydroxymethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]-1-methyl-3-phenylurea IUPAC Name: 1-[(3S,4S)-6-bromo-3-(hydroxymethyl)-3,4-dihydro-2H-chromen-4-yl]-1-methyl-3-phenylurea Traditional Name: 1-[(3S,4S)-6-bromo-3-methylol-chroman-4-yl]-1-methyl-3-phenyl-urea Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1C(COC2=C1C=C(C=C2)Br)CO)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN([C@H]1[C@H](COC2=C1C=C(C=C2)Br)CO)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H19BrN2O3/c1-21(18(23)20-14-5-3-2-4-6-14)17-12(10-22)11-24-16-8-7-13(19)9-15(16)17/h2-9,12,17,22H,10-11H2,1H3,(H,20,23)/t12-,17-/m0/s1