N-[(2S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-ethoxy-benzamide

Systemtic Name: N-[(2S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-ethoxy-benzamide Openeye Name: N-[(1S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoyl]-2-methyl-propyl]-2-ethoxy-benzamide CAS Name: N-[(2S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-methyl-1-oxobutan-2-yl]-2-ethoxybenzamide IUPAC Name: N-[(2S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-methyl-1-oxobutan-2-yl]-2-ethoxybenzamide Traditional Name: N-[(1S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoyl]-2-methyl-propyl]-2-ethoxy-benzamide Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C23H28N2O5/c1-4-28-18-10-6-5-9-17(18)22(26)25-21(15(2)3)23(27)24-13-16-14-29-19-11-7-8-12-20(19)30-16/h5-12,15-16,21H,4,13-14H2,1-3H3,(H,24,27)(H,25,26)/t16-,21-/m0/s1