tert-butyl 2-[(8-methyl-2-oxidanylidene-5-phenyl-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-3-yl)amino]oxyethanoate

Systemtic Name: tert-butyl 2-[(8-methyl-2-oxidanylidene-5-phenyl-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-3-yl)amino]oxyethanoate Openeye Name: tert-butyl 2-[(8-methyl-2-oxo-5-phenyl-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-3-yl)amino]oxyacetate CAS Name: 2-[(8-methyl-2-oxo-5-phenyl-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-3-yl)amino]oxyacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(8-methyl-2-oxo-5-phenyl-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-3-yl)amino]oxyacetate Traditional Name: 2-[(2-keto-8-methyl-5-phenyl-7,9-dihydro-6H-pyrrol[3,2-h]isoquinolin-3-yl)amino]oxyacetic acid tert-butyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CONC1=C2C=C(C3=C(C2=NC1=O)CN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)CONC1=C2C=C(C3=C(C2=NC1=O)CN(CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4/c1-24(2,3)31-20(28)14-30-26-22-18-12-17(15-8-6-5-7-9-15)16-10-11-27(4)13-19(16)21(18)25-23(22)29/h5-9,12H,10-11,13-14H2,1-4H3,(H,25,26,29)