4-[bis(oxidanyl)amino]-7-methoxy-3-methyl-5-[methylsulfonyl(prop-2-enyl)amino]-1H-indole-2-carboxylate

Systemtic Name: 4-[bis(oxidanyl)amino]-7-methoxy-3-methyl-5-[methylsulfonyl(prop-2-enyl)amino]-1H-indole-2-carboxylate Openeye Name: 5-[allyl(methylsulfonyl)amino]-4-(dihydroxyamino)-7-methoxy-3-methyl-1H-indole-2-carboxylate CAS Name: 4-(dihydroxyamino)-7-methoxy-3-methyl-5-[methylsulfonyl(prop-2-enyl)amino]-1H-indole-2-carboxylate IUPAC Name: 4-(dihydroxyamino)-7-methoxy-3-methyl-5-[methylsulfonyl(prop-2-enyl)amino]-1H-indole-2-carboxylate Traditional Name: 5-[allyl(mesyl)amino]-4-(dihydroxyamino)-7-methoxy-3-methyl-1H-indole-2-carboxylate Formula: C15H18N3O7S- MolecularWeight: 384.38432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(C=C(C(=C12)N(O)O)N(CC=C)S(=O)(=O)C)OC)C(=O)[O-]

Isomeric SMILES

CC1=C(NC2=C(C=C(C(=C12)N(O)O)N(CC=C)S(=O)(=O)C)OC)C(=O)[O-]

InChI

InChI=1S/C15H19N3O7S/c1-5-6-17(26(4,23)24)9-7-10(25-3)13-11(14(9)18(21)22)8(2)12(16-13)15(19)20/h5,7,16,21-22H,1,6H2,2-4H3,(H,19,20)/p-1