tert-butyl 2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoate Openeye Name: tert-butyl 2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoate CAS Name: 2-[(4-nitrophenyl)sulfonyl-phenacylamino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-nitrophenyl)sulfonyl-phenacylamino]-3-phenylpropanoate Traditional Name: 2-[nosyl(phenacyl)amino]-3-phenyl-propionic acid tert-butyl ester Formula: C27H28N2O7S MolecularWeight: 524.58542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)N(CC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)N(CC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H28N2O7S/c1-27(2,3)36-26(31)24(18-20-10-6-4-7-11-20)28(19-25(30)21-12-8-5-9-13-21)37(34,35)23-16-14-22(15-17-23)29(32)33/h4-17,24H,18-19H2,1-3H3