methyl 2-[(2-nitrophenyl)sulfonyl-[(2R)-1-phenylmethoxybut-3-en-2-yl]amino]ethanoate

Systemtic Name: methyl 2-[(2-nitrophenyl)sulfonyl-[(2R)-1-phenylmethoxybut-3-en-2-yl]amino]ethanoate Openeye Name: methyl 2-[[(1R)-1-(benzyloxymethyl)allyl]-(2-nitrophenyl)sulfonyl-amino]acetate CAS Name: 2-[(2-nitrophenyl)sulfonyl-[(2R)-1-phenylmethoxybut-3-en-2-yl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-nitrophenyl)sulfonyl-[(2R)-1-phenylmethoxybut-3-en-2-yl]amino]acetate Traditional Name: 2-[[(1R)-1-(benzoxymethyl)allyl]-(2-nitrophenyl)sulfonyl-amino]acetic acid methyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(C(COCC1=CC=CC=C1)C=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)CN([C@@H](COCC1=CC=CC=C1)C=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O7S/c1-3-17(15-29-14-16-9-5-4-6-10-16)21(13-20(23)28-2)30(26,27)19-12-8-7-11-18(19)22(24)25/h3-12,17H,1,13-15H2,2H3/t17-/m1/s1