4-[4-[[(9S)-11-butyl-9-(hydroxymethyl)-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methyl-benzamide

Systemtic Name: 4-[4-[[(9S)-11-butyl-9-(hydroxymethyl)-7,10-bis(oxidanylidene)-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methyl-benzamide Openeye Name: 4-[4-[[(9S)-11-butyl-9-(hydroxymethyl)-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methyl-benzamide CAS Name: 4-[4-[[(9S)-11-butyl-9-(hydroxymethyl)-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methylbenzamide IUPAC Name: 4-[4-[[(9S)-11-butyl-9-(hydroxymethyl)-7,10-dioxo-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methylbenzamide Traditional Name: 4-[4-[[(9S)-11-butyl-7,10-diketo-9-methylol-3,8,11-triazaspiro[5.5]undecan-3-yl]methyl]phenoxy]-N-methyl-benzamide Formula: C28H36N4O5 MolecularWeight: 508.60924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)NC)CO

Isomeric SMILES

CCCCN1C(=O)[C@@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)C(=O)NC)CO

InChI

InChI=1S/C28H36N4O5/c1-3-4-15-32-26(35)24(19-33)30-27(36)28(32)13-16-31(17-14-28)18-20-5-9-22(10-6-20)37-23-11-7-21(8-12-23)25(34)29-2/h5-12,24,33H,3-4,13-19H2,1-2H3,(H,29,34)(H,30,36)/t24-/m0/s1