3-[3-azanyl-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[3-azanyl-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 3-[3-amino-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propanoic acid CAS Name: 3-[3-amino-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 3-[3-amino-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 3-[3-amino-4-(2-ethylbutoxy)-5-(1H-indol-5-yl)phenyl]propionic acid Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)COC1=C(C=C(C=C1C2=CC3=C(C=C2)NC=C3)CCC(=O)O)N

Isomeric SMILES

CCC(CC)COC1=C(C=C(C=C1C2=CC3=C(C=C2)NC=C3)CCC(=O)O)N

InChI

InChI=1S/C23H28N2O3/c1-3-15(4-2)14-28-23-19(11-16(12-20(23)24)5-8-22(26)27)17-6-7-21-18(13-17)9-10-25-21/h6-7,9-13,15,25H,3-5,8,14,24H2,1-2H3,(H,26,27)