2-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropyl]carbonylamino]-1H-indol-2-yl]ethanoic acid

Systemtic Name: 2-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropyl]carbonylamino]-1H-indol-2-yl]ethanoic acid Openeye Name: 2-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-1H-indol-2-yl]acetic acid CAS Name: 2-[5-[[[1-(1,3-benzodioxol-5-yl)cyclopropyl]-oxomethyl]amino]-1H-indol-2-yl]acetic acid IUPAC Name: 2-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-1H-indol-2-yl]acetic acid Traditional Name: 2-[5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-1H-indol-2-yl]acetic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC5=C(C=C4)NC(=C5)CC(=O)O

Isomeric SMILES

C1CC1(C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC5=C(C=C4)NC(=C5)CC(=O)O

InChI

InChI=1S/C21H18N2O5/c24-19(25)10-15-8-12-7-14(2-3-16(12)22-15)23-20(26)21(5-6-21)13-1-4-17-18(9-13)28-11-27-17/h1-4,7-9,22H,5-6,10-11H2,(H,23,26)(H,24,25)