(4S,7S,10S)-4-(hydroxymethyl)-15-iodanyl-7-(2-methylpropyl)-17-nitro-2,5,8-tris(oxidanylidene)-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide

Systemtic Name: (4S,7S,10S)-4-(hydroxymethyl)-15-iodanyl-7-(2-methylpropyl)-17-nitro-2,5,8-tris(oxidanylidene)-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide Openeye Name: (4S,7S,10S)-4-(hydroxymethyl)-15-iodo-7-isobutyl-17-nitro-2,5,8-trioxo-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide CAS Name: (4S,7S,10S)-4-(hydroxymethyl)-15-iodo-7-(2-methylpropyl)-17-nitro-2,5,8-trioxo-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide IUPAC Name: (4S,7S,10S)-4-(hydroxymethyl)-15-iodo-7-(2-methylpropyl)-17-nitro-2,5,8-trioxo-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide Traditional Name: (4S,7S,10S)-15-iodo-7-isobutyl-2,5,8-triketo-4-methylol-17-nitro-13-oxa-3,6,9-triazabicyclo[12.4.0]octadeca-1(14),15,17-triene-10-carboxamide Formula: C20H26IN5O8 MolecularWeight: 591.35361

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC(CCOC2=C(C=C(C=C2C(=O)NC(C(=O)N1)CO)[N+](=O)[O-])I)C(=O)N

Isomeric SMILES

CC(C)C[C@H]1C(=O)N[C@@H](CCOC2=C(C=C(C=C2C(=O)N[C@H](C(=O)N1)CO)[N+](=O)[O-])I)C(=O)N

InChI

InChI=1S/C20H26IN5O8/c1-9(2)5-14-19(30)23-13(17(22)28)3-4-34-16-11(6-10(26(32)33)7-12(16)21)18(29)25-15(8-27)20(31)24-14/h6-7,9,13-15,27H,3-5,8H2,1-2H3,(H2,22,28)(H,23,30)(H,24,31)(H,25,29)/t13-,14-,15-/m0/s1