(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoate IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-(1H-indol-3-yl)propionate Formula: C20H18N3O5- MolecularWeight: 380.37402

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C20H19N3O5/c24-19(25)16(9-12-11-21-15-4-2-1-3-14(12)15)23-20(26)22-13-5-6-17-18(10-13)28-8-7-27-17/h1-6,10-11,16,21H,7-9H2,(H,24,25)(H2,22,23,26)/p-1/t16-/m0/s1