2-[[3-(4-butoxyphenyl)-3-oxidanylidene-propyl]amino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[3-(4-butoxyphenyl)-3-oxidanylidene-propyl]amino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[3-(4-butoxyphenyl)-3-oxo-propyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[3-(4-butoxyphenyl)-3-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[3-(4-butoxyphenyl)-3-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[3-(4-butoxyphenyl)-3-keto-propyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)CCNC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)CCNC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C24H28N2O4/c1-2-3-14-30-19-10-8-17(9-11-19)23(27)12-13-25-22(24(28)29)15-18-16-26-21-7-5-4-6-20(18)21/h4-11,16,22,25-26H,2-3,12-15H2,1H3,(H,28,29)