tert-butyl N-[[4-[methyl-[(3-nitrophenyl)methyl]carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[methyl-[(3-nitrophenyl)methyl]carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[methyl-[(3-nitrophenyl)methyl]carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[methyl-[(3-nitrophenyl)methyl]amino]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[methyl-[(3-nitrophenyl)methyl]carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[methyl-(3-nitrobenzyl)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-21(2,3)29-20(26)22-13-15-8-10-17(11-9-15)19(25)23(4)14-16-6-5-7-18(12-16)24(27)28/h5-12H,13-14H2,1-4H3,(H,22,26)