N-(1-adamantylcarbamoyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)propionamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H29N3O4/c1-13(23-17-2-3-18-19(9-17)29-5-4-28-18)20(26)24-21(27)25-22-10-14-6-15(11-22)8-16(7-14)12-22/h2-3,9,13-16,23H,4-8,10-12H2,1H3,(H2,24,25,26,27)