tert-butyl N-[(Z,2S)-4-(4-nitrophenyl)-3-oxidanyl-1-phenyl-but-3-en-2-yl]carbamate

Systemtic Name: tert-butyl N-[(Z,2S)-4-(4-nitrophenyl)-3-oxidanyl-1-phenyl-but-3-en-2-yl]carbamate Openeye Name: tert-butyl N-[(Z,1S)-1-benzyl-2-hydroxy-3-(4-nitrophenyl)allyl]carbamate CAS Name: N-[(Z,2S)-3-hydroxy-4-(4-nitrophenyl)-1-phenylbut-3-en-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(Z,2S)-3-hydroxy-4-(4-nitrophenyl)-1-phenylbut-3-en-2-yl]carbamate Traditional Name: N-[(Z,1S)-1-benzyl-2-hydroxy-3-(4-nitrophenyl)allyl]carbamic acid tert-butyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=CC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/O

InChI

InChI=1S/C21H24N2O5/c1-21(2,3)28-20(25)22-18(13-15-7-5-4-6-8-15)19(24)14-16-9-11-17(12-10-16)23(26)27/h4-12,14,18,24H,13H2,1-3H3,(H,22,25)/b19-14-/t18-/m0/s1