N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propanamide

Systemtic Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propanamide Openeye Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propanamide CAS Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propanamide Traditional Name: N-(1-adamantylmethyl)-3-(1,3-benzodioxol-5-yl)propionamide Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H27NO3/c23-20(4-2-14-1-3-18-19(8-14)25-13-24-18)22-12-21-9-15-5-16(10-21)7-17(6-15)11-21/h1,3,8,15-17H,2,4-7,9-13H2,(H,22,23)