tert-butyl N-[1-[(4-nitrophenyl)carbonylamino]-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(4-nitrophenyl)carbonylamino]-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[(4-nitrobenzoyl)amino]ethyl]carbamate CAS Name: N-[1-[[(4-nitrophenyl)-oxomethyl]amino]-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(4-nitrobenzoyl)amino]-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[(4-nitrobenzoyl)amino]ethyl]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)NC(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-21(2,3)29-20(26)23-17(13-15-7-5-4-6-8-15)14-22-19(25)16-9-11-18(12-10-16)24(27)28/h4-12,17H,13-14H2,1-3H3,(H,22,25)(H,23,26)