4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(3R,4R)-1-(1-methylpiperidin-4-yl)-4-oxidanyl-azepan-3-yl]benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(3R,4R)-1-(1-methylpiperidin-4-yl)-4-oxidanyl-azepan-3-yl]benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-N-[(3R,4R)-4-hydroxy-1-(1-methyl-4-piperidyl)azepan-3-yl]benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-N-[(3R,4R)-4-hydroxy-1-(1-methyl-4-piperidinyl)-3-azepanyl]benzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-N-[(3R,4R)-4-hydroxy-1-(1-methylpiperidin-4-yl)azepan-3-yl]benzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-N-[(3R,4R)-4-hydroxy-1-(1-methyl-4-piperidyl)azepan-3-yl]benzamide Formula: C21H32N4O4 MolecularWeight: 404.50318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2CCCC(C(C2)NC(=O)C3=CC=C(C=C3)OCC(=O)N)O

Isomeric SMILES

CN1CCC(CC1)N2CCC[C@H]([C@@H](C2)NC(=O)C3=CC=C(C=C3)OCC(=O)N)O

InChI

InChI=1S/C21H32N4O4/c1-24-11-8-16(9-12-24)25-10-2-3-19(26)18(13-25)23-21(28)15-4-6-17(7-5-15)29-14-20(22)27/h4-7,16,18-19,26H,2-3,8-14H2,1H3,(H2,22,27)(H,23,28)/t18-,19-/m1/s1