N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(oxidanylamino)-7-oxidanylidene-heptyl]-1H-indole-2-carboxamide

Systemtic Name: N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(oxidanylamino)-7-oxidanylidene-heptyl]-1H-indole-2-carboxamide Openeye Name: N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(hydroxyamino)-7-oxo-heptyl]-1H-indole-2-carboxamide CAS Name: N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(hydroxyamino)-7-oxoheptyl]-1H-indole-2-carboxamide IUPAC Name: N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(hydroxyamino)-7-oxoheptyl]-1H-indole-2-carboxamide Traditional Name: N-[(1S)-1-(3H-benzo[e]benzimidazol-2-yl)-7-(hydroxyamino)-7-keto-heptyl]-1H-indole-2-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(N3)C(CCCCCC(=O)NO)NC(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(N3)[C@H](CCCCCC(=O)NO)NC(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C27H27N5O3/c33-24(32-35)13-3-1-2-12-22(30-27(34)23-16-18-9-5-7-11-20(18)28-23)26-29-21-15-14-17-8-4-6-10-19(17)25(21)31-26/h4-11,14-16,22,28,35H,1-3,12-13H2,(H,29,31)(H,30,34)(H,32,33)/t22-/m0/s1