4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(3R,4R)-4-oxidanylazepan-3-yl]benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(3R,4R)-4-oxidanylazepan-3-yl]benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-N-[(3R,4R)-4-hydroxyazepan-3-yl]benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-N-[(3R,4R)-4-hydroxy-3-azepanyl]benzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-N-[(3R,4R)-4-hydroxyazepan-3-yl]benzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-N-[(3R,4R)-4-hydroxyazepan-3-yl]benzamide Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CNC1)NC(=O)C2=CC=C(C=C2)OCC(=O)N)O

Isomeric SMILES

C1C[C@H]([C@@H](CNC1)NC(=O)C2=CC=C(C=C2)OCC(=O)N)O

InChI

InChI=1S/C15H21N3O4/c16-14(20)9-22-11-5-3-10(4-6-11)15(21)18-12-8-17-7-1-2-13(12)19/h3-6,12-13,17,19H,1-2,7-9H2,(H2,16,20)(H,18,21)/t12-,13-/m1/s1