tert-butyl N-[[3-oxidanyl-4-(pyridin-4-ylcarbamoyl)phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-oxidanyl-4-(pyridin-4-ylcarbamoyl)phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-hydroxy-4-(4-pyridylcarbamoyl)phenyl]methyl]carbamate CAS Name: N-[[3-hydroxy-4-[oxo-(pyridin-4-ylamino)methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-hydroxy-4-(pyridin-4-ylcarbamoyl)phenyl]methyl]carbamate Traditional Name: N-[3-hydroxy-4-(4-pyridylcarbamoyl)benzyl]carbamic acid tert-butyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)C(=O)NC2=CC=NC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)C(=O)NC2=CC=NC=C2)O

InChI

InChI=1S/C18H21N3O4/c1-18(2,3)25-17(24)20-11-12-4-5-14(15(22)10-12)16(23)21-13-6-8-19-9-7-13/h4-10,22H,11H2,1-3H3,(H,20,24)(H,19,21,23)