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

Systemtic Name: 3-methyl-1-oxidanyl-1-[(E)-3-[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea Openeye Name: 1-hydroxy-3-methyl-1-[(E)-3-[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]allyl]urea CAS Name: 1-hydroxy-3-methyl-1-[(E)-3-[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-6-yl]prop-2-enyl]urea IUPAC Name: 1-hydroxy-3-methyl-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]-3-methyl-urea Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N(CC=CC1=CC2=C(C=C1)C(=O)N(CC2)CCCC3=CC=CC=C3)O

Isomeric SMILES

CNC(=O)N(C/C=C/C1=CC2=C(C=C1)C(=O)N(CC2)CCCC3=CC=CC=C3)O

InChI

InChI=1S/C23H27N3O3/c1-24-23(28)26(29)15-6-10-19-11-12-21-20(17-19)13-16-25(22(21)27)14-5-9-18-7-3-2-4-8-18/h2-4,6-8,10-12,17,29H,5,9,13-16H2,1H3,(H,24,28)/b10-6+