N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propionamide Formula: C23H31NO5S MolecularWeight: 433.56094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCS(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCS(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H31NO5S/c1-15(23-12-16-8-17(13-23)10-18(9-16)14-23)24-22(25)4-7-30(26,27)19-2-3-20-21(11-19)29-6-5-28-20/h2-3,11,15-18H,4-10,12-14H2,1H3,(H,24,25)