tert-butyl 4-[(6-methoxy-1,1,4,4-tetramethyl-3H-isochromen-7-yl)carbamoylamino]benzoate

Systemtic Name: tert-butyl 4-[(6-methoxy-1,1,4,4-tetramethyl-3H-isochromen-7-yl)carbamoylamino]benzoate Openeye Name: tert-butyl 4-[(6-methoxy-1,1,4,4-tetramethyl-isochroman-7-yl)carbamoylamino]benzoate CAS Name: 4-[[[(6-methoxy-1,1,4,4-tetramethyl-3,4-dihydro-1H-2-benzopyran-7-yl)amino]-oxomethyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-methoxy-1,1,4,4-tetramethyl-3H-isochromen-7-yl)carbamoylamino]benzoate Traditional Name: 4-[(6-methoxy-1,1,4,4-tetramethyl-isochroman-7-yl)carbamoylamino]benzoic acid tert-butyl ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(C2=CC(=C(C=C21)OC)NC(=O)NC3=CC=C(C=C3)C(=O)OC(C)(C)C)(C)C)C

Isomeric SMILES

CC1(COC(C2=CC(=C(C=C21)OC)NC(=O)NC3=CC=C(C=C3)C(=O)OC(C)(C)C)(C)C)C

InChI

InChI=1S/C26H34N2O5/c1-24(2,3)33-22(29)16-9-11-17(12-10-16)27-23(30)28-20-13-19-18(14-21(20)31-8)25(4,5)15-32-26(19,6)7/h9-14H,15H2,1-8H3,(H2,27,28,30)