3-methyl-4-(1-methyl-3-oxidanylidene-1-azacyclotridec-2-yl)-4-oxidanyl-N-(phenylmethyl)butanamide

Systemtic Name: 3-methyl-4-(1-methyl-3-oxidanylidene-1-azacyclotridec-2-yl)-4-oxidanyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)butanamide CAS Name: 4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-hydroxy-3-methyl-4-(1-methyl-3-oxo-azacyclotridec-2-yl)butanamide Traditional Name: N-benzyl-4-hydroxy-4-(3-keto-1-methyl-azacyclotridec-2-yl)-3-methyl-butyramide Formula: C25H40N2O3 MolecularWeight: 416.5967

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC1=CC=CC=C1)C(C2C(=O)CCCCCCCCCCN2C)O

Isomeric SMILES

CC(CC(=O)NCC1=CC=CC=C1)C(C2C(=O)CCCCCCCCCCN2C)O

InChI

InChI=1S/C25H40N2O3/c1-20(18-23(29)26-19-21-14-10-9-11-15-21)25(30)24-22(28)16-12-7-5-3-4-6-8-13-17-27(24)2/h9-11,14-15,20,24-25,30H,3-8,12-13,16-19H2,1-2H3,(H,26,29)