N-(4-cyano-1-propyl-piperidin-4-yl)-3-cyclooctyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]propanamide

Systemtic Name: N-(4-cyano-1-propyl-piperidin-4-yl)-3-cyclooctyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]propanamide Openeye Name: N-(4-cyano-1-propyl-4-piperidyl)-3-cyclooctyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide CAS Name: N-(4-cyano-1-propyl-4-piperidinyl)-3-cyclooctyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide IUPAC Name: N-(4-cyano-1-propylpiperidin-4-yl)-3-cyclooctyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide Traditional Name: N-(4-cyano-1-propyl-4-piperidyl)-3-cyclooctyl-2-[(2-keto-1,3-benzoxazin-4-yl)amino]propionamide Formula: C28H39N5O3 MolecularWeight: 493.64096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCCCC2)NC3=NC(=O)OC4=CC=CC=C43

Isomeric SMILES

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCCCC2)NC3=NC(=O)OC4=CC=CC=C43

InChI

InChI=1S/C28H39N5O3/c1-2-16-33-17-14-28(20-29,15-18-33)32-26(34)23(19-21-10-6-4-3-5-7-11-21)30-25-22-12-8-9-13-24(22)36-27(35)31-25/h8-9,12-13,21,23H,2-7,10-11,14-19H2,1H3,(H,32,34)(H,30,31,35)