N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]propanamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(3-methylbutanoyl)piperazin-1-yl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-isovalerylpiperazino)propionamide Formula: C21H30N4O5 MolecularWeight: 418.4867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(C)C(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(C)C(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H30N4O5/c1-14(2)12-19(26)25-8-6-24(7-9-25)15(3)20(27)23-21(28)22-16-4-5-17-18(13-16)30-11-10-29-17/h4-5,13-15H,6-12H2,1-3H3,(H2,22,23,27,28)