tert-butyl N-[3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]phenyl]carbamate CAS Name: N-[3-[[methyl-[1-(3-nitrophenyl)ethyl]amino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]phenyl]carbamate Traditional Name: N-[3-[methyl-[1-(3-nitrophenyl)ethyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC(=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC(=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H25N3O5/c1-14(15-8-7-11-18(13-15)24(27)28)23(5)19(25)16-9-6-10-17(12-16)22-20(26)29-21(2,3)4/h6-14H,1-5H3,(H,22,26)