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1-oxidanyl-1-[(E)-3-[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea

1-oxidanyl-1-[(E)-3-[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea

Systemtic Name:1-oxidanyl-1-[(E)-3-[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea
Openeye Name:1-hydroxy-1-[(E)-3-[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]allyl]urea
CAS Name:1-hydroxy-1-[(E)-3-[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea
IUPAC Name:1-hydroxy-1-[(E)-3-[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea
Traditional Name:1-hydroxy-1-[(E)-3-[1-keto-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]allyl]urea
Formula: C22H25N3O3
MolecularWeight: 379.4522
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)C=CCN(C(=O)N)O)CCCC3=CC=CC=C3


Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)/C=C/CN(C(=O)N)O)CCCC3=CC=CC=C3


InChI

InChI=1S/C22H25N3O3/c23-22(27)25(28)14-5-9-18-10-11-20-19(16-18)12-15-24(21(20)26)13-4-8-17-6-2-1-3-7-17/h1-3,5-7,9-11,16,28H,4,8,12-15H2,(H2,23,27)/b9-5+


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