1-(3-propan-2-yloxyphenyl)-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea

Systemtic Name: 1-(3-propan-2-yloxyphenyl)-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea Openeye Name: 1-(3-isopropoxyphenyl)-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)urea CAS Name: 1-(3-propan-2-yloxyphenyl)-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)urea IUPAC Name: 1-(3-propan-2-yloxyphenyl)-3-(2,6,7-trimethyl-1-oxo-4-phenylisoquinolin-3-yl)urea Traditional Name: 1-(3-isopropoxyphenyl)-3-(1-keto-2,6,7-trimethyl-4-phenyl-3-isoquinolyl)urea Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)NC3=CC(=CC=C3)OC(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)NC3=CC(=CC=C3)OC(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C28H29N3O3/c1-17(2)34-22-13-9-12-21(16-22)29-28(33)30-26-25(20-10-7-6-8-11-20)23-14-18(3)19(4)15-24(23)27(32)31(26)5/h6-17H,1-5H3,(H2,29,30,33)