tert-butyl N-[1-oxidanylidene-1-[(5-oxidanyl-3-phenyl-3,4-dihydro-1H-isochromen-1-yl)methylamino]pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-1-[(5-oxidanyl-3-phenyl-3,4-dihydro-1H-isochromen-1-yl)methylamino]pentan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(5-hydroxy-3-phenyl-isochroman-1-yl)methylcarbamoyl]butyl]carbamate CAS Name: N-[1-[(5-hydroxy-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-yl)methylamino]-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(5-hydroxy-3-phenyl-3,4-dihydro-1H-isochromen-1-yl)methylamino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[(5-hydroxy-3-phenyl-isochroman-1-yl)methylcarbamoyl]butyl]carbamic acid tert-butyl ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCC1C2=C(CC(O1)C3=CC=CC=C3)C(=CC=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)NCC1C2=C(CC(O1)C3=CC=CC=C3)C(=CC=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H34N2O5/c1-5-10-20(28-25(31)33-26(2,3)4)24(30)27-16-23-18-13-9-14-21(29)19(18)15-22(32-23)17-11-7-6-8-12-17/h6-9,11-14,20,22-23,29H,5,10,15-16H2,1-4H3,(H,27,30)(H,28,31)