1-oxidanyl-1-[2-[[1-oxidanylidene-2-[(E)-3-phenylprop-2-enyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea

Systemtic Name: 1-oxidanyl-1-[2-[[1-oxidanylidene-2-[(E)-3-phenylprop-2-enyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Openeye Name: 1-[2-[[2-[(E)-cinnamyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]-1-hydroxy-urea CAS Name: 1-hydroxy-1-[2-[[1-oxo-2-[(E)-3-phenylprop-2-enyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea IUPAC Name: 1-hydroxy-1-[2-[[1-oxo-2-[(E)-3-phenylprop-2-enyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Traditional Name: 1-[2-[[2-[(E)-cinnamyl]-1-keto-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]-1-hydroxy-urea Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CC=CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4/c22-21(26)24(27)13-14-28-18-8-9-19-17(15-18)10-12-23(20(19)25)11-4-7-16-5-2-1-3-6-16/h1-9,15,27H,10-14H2,(H2,22,26)/b7-4+