tert-butyl N-[3-[4-azanyl-3-(3-oxidanylidenepropyl)phenoxy]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-azanyl-3-(3-oxidanylidenepropyl)phenoxy]propyl]carbamate Openeye Name: tert-butyl N-[3-[4-amino-3-(3-oxopropyl)phenoxy]propyl]carbamate CAS Name: N-[3-[4-amino-3-(3-oxopropyl)phenoxy]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-amino-3-(3-oxopropyl)phenoxy]propyl]carbamate Traditional Name: N-[3-[4-amino-3-(3-ketopropyl)phenoxy]propyl]carbamic acid tert-butyl ester Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC1=CC(=C(C=C1)N)CCC=O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC1=CC(=C(C=C1)N)CCC=O

InChI

InChI=1S/C17H26N2O4/c1-17(2,3)23-16(21)19-9-5-11-22-14-7-8-15(18)13(12-14)6-4-10-20/h7-8,10,12H,4-6,9,11,18H2,1-3H3,(H,19,21)