N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-chloranyl-5-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-chloranyl-5-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[(3S)-1,1-dioxo-3-thiolanyl]-5-nitro-N-prop-2-enylbenzamide IUPAC Name: 2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-5-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-chloro-N-[(3S)-1,1-diketothiolan-3-yl]-5-nitro-benzamide Formula: C14H15ClN2O5S MolecularWeight: 358.7973

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCN([C@H]1CCS(=O)(=O)C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN2O5S/c1-2-6-16(11-5-7-23(21,22)9-11)14(18)12-8-10(17(19)20)3-4-13(12)15/h2-4,8,11H,1,5-7,9H2/t11-/m0/s1