(E)-4-oxidanylidene-4-[1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-yl]oxy-but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-yl]oxy-but-2-enoic acid Openeye Name: (E)-4-[1-[(isopropylamino)methyl]-2-(2-pyrrol-1-ylphenoxy)ethoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[1-(propan-2-ylamino)-3-[2-(1-pyrrolyl)phenoxy]propan-2-yl]oxy-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-yl]oxybut-2-enoic acid Traditional Name: (E)-4-[1-[(isopropylamino)methyl]-2-(2-pyrrol-1-ylphenoxy)ethoxy]-4-keto-but-2-enoic acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC=C1N2C=CC=C2)OC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)NCC(COC1=CC=CC=C1N2C=CC=C2)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C20H24N2O5/c1-15(2)21-13-16(27-20(25)10-9-19(23)24)14-26-18-8-4-3-7-17(18)22-11-5-6-12-22/h3-12,15-16,21H,13-14H2,1-2H3,(H,23,24)/b10-9+