ethyl 4-[2-[[(E)-3-(1-propylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate

Systemtic Name: ethyl 4-[2-[[(E)-3-(1-propylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate Openeye Name: ethyl 4-[2-[[(E)-3-(1-propylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate CAS Name: 4-[2-[[(E)-1-oxo-3-(1-propyl-5-indolyl)but-2-enyl]amino]phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(E)-3-(1-propylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate Traditional Name: 4-[2-[[(E)-3-(1-propylindol-5-yl)but-2-enoyl]amino]phenoxy]butyric acid ethyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC2=C1C=CC(=C2)C(=CC(=O)NC3=CC=CC=C3OCCCC(=O)OCC)C

Isomeric SMILES

CCCN1C=CC2=C1C=CC(=C2)/C(=C/C(=O)NC3=CC=CC=C3OCCCC(=O)OCC)/C

InChI

InChI=1S/C27H32N2O4/c1-4-15-29-16-14-22-19-21(12-13-24(22)29)20(3)18-26(30)28-23-9-6-7-10-25(23)33-17-8-11-27(31)32-5-2/h6-7,9-10,12-14,16,18-19H,4-5,8,11,15,17H2,1-3H3,(H,28,30)/b20-18+