2-[2-[2-azanyl-3-(1,3-benzodioxol-5-yl)-6-propoxy-2,3-dihydro-1H-inden-1-yl]-5-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[2-azanyl-3-(1,3-benzodioxol-5-yl)-6-propoxy-2,3-dihydro-1H-inden-1-yl]-5-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[2-[2-amino-3-(1,3-benzodioxol-5-yl)-6-propoxy-indan-1-yl]-5-methoxy-phenoxy]acetic acid CAS Name: 2-[2-[2-amino-3-(1,3-benzodioxol-5-yl)-6-propoxy-2,3-dihydro-1H-inden-1-yl]-5-methoxyphenoxy]acetic acid IUPAC Name: 2-[2-[2-amino-3-(1,3-benzodioxol-5-yl)-6-propoxy-2,3-dihydro-1H-inden-1-yl]-5-methoxyphenoxy]acetic acid Traditional Name: 2-[2-[2-amino-3-(1,3-benzodioxol-5-yl)-6-propoxy-indan-1-yl]-5-methoxy-phenoxy]acetic acid Formula: C28H29NO7 MolecularWeight: 491.53236

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)O)N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)O)N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H29NO7/c1-3-10-33-18-6-7-19-21(12-18)27(20-8-5-17(32-2)13-23(20)34-14-25(30)31)28(29)26(19)16-4-9-22-24(11-16)36-15-35-22/h4-9,11-13,26-28H,3,10,14-15,29H2,1-2H3,(H,30,31)