tert-butyl N-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]carbamate

Systemtic Name: tert-butyl N-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]carbamate Openeye Name: tert-butyl N-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolylidene]methylamino]carbamate CAS Name: N-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolinylidene]methylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-(4-ethoxyphenyl)-1,3-dioxoisoquinolin-4-ylidene]methylamino]carbamate Traditional Name: N-[(1,3-diketo-2-p-phenetyl-4-isoquinolylidene)methylamino]carbamic acid tert-butyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)OC(C)(C)C)C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)OC(C)(C)C)C2=O

InChI

InChI=1S/C23H25N3O5/c1-5-30-16-12-10-15(11-13-16)26-20(27)18-9-7-6-8-17(18)19(21(26)28)14-24-25-22(29)31-23(2,3)4/h6-14,24H,5H2,1-4H3,(H,25,29)