11-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-(2-cyclooctylethylamino)-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]undecanamide

Systemtic Name: 11-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-(2-cyclooctylethylamino)-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]undecanamide Openeye Name: 11-amino-N-[(1S)-2-[[(1S)-5-amino-1-(2-cyclooctylethylcarbamoyl)pentyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]undecanamide CAS Name: 11-amino-N-[(2S)-1-[[(2S)-6-amino-1-(2-cyclooctylethylamino)-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]undecanamide IUPAC Name: 11-amino-N-[(2S)-1-[[(2S)-6-amino-1-(2-cyclooctylethylamino)-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]undecanamide Traditional Name: 11-amino-N-[(1S)-2-[[(1S)-5-amino-1-(2-cyclooctylethylcarbamoyl)pentyl]amino]-2-keto-1-methylol-ethyl]undecanamide Formula: C30H59N5O4 MolecularWeight: 553.82056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CCNC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)CCCCCCCCCCN

Isomeric SMILES

C1CCCC(CCC1)CCNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CCCCCCCCCCN

InChI

InChI=1S/C30H59N5O4/c31-21-14-9-4-2-1-3-8-12-19-28(37)34-27(24-36)30(39)35-26(18-13-15-22-32)29(38)33-23-20-25-16-10-6-5-7-11-17-25/h25-27,36H,1-24,31-32H2,(H,33,38)(H,34,37)(H,35,39)/t26-,27-/m0/s1