methyl (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2,4-dinitrophenyl)sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C16H15N3O8S MolecularWeight: 409.3706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O8S/c1-27-16(20)13(9-11-5-3-2-4-6-11)17-28(25,26)15-8-7-12(18(21)22)10-14(15)19(23)24/h2-8,10,13,17H,9H2,1H3/t13-/m0/s1