tert-butyl N-[3-(3-iodanyl-2-methoxy-5-nitro-phenyl)prop-2-ynyl]carbamate

Systemtic Name: tert-butyl N-[3-(3-iodanyl-2-methoxy-5-nitro-phenyl)prop-2-ynyl]carbamate Openeye Name: tert-butyl N-[3-(3-iodo-2-methoxy-5-nitro-phenyl)prop-2-ynyl]carbamate CAS Name: N-[3-(3-iodo-2-methoxy-5-nitrophenyl)prop-2-ynyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(3-iodo-2-methoxy-5-nitrophenyl)prop-2-ynyl]carbamate Traditional Name: N-[3-(3-iodo-2-methoxy-5-nitro-phenyl)prop-2-ynyl]carbamic acid tert-butyl ester Formula: C15H17IN2O5 MolecularWeight: 432.21035

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC#CC1=CC(=CC(=C1OC)I)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCC#CC1=CC(=CC(=C1OC)I)[N+](=O)[O-]

InChI

InChI=1S/C15H17IN2O5/c1-15(2,3)23-14(19)17-7-5-6-10-8-11(18(20)21)9-12(16)13(10)22-4/h8-9H,7H2,1-4H3,(H,17,19)