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

Systemtic Name: ethyl 4-[2-[[(E)-3-(1-methylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate Openeye Name: ethyl 4-[2-[[(E)-3-(1-methylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate CAS Name: 4-[2-[[(E)-3-(1-methyl-5-indolyl)-1-oxobut-2-enyl]amino]phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(E)-3-(1-methylindol-5-yl)but-2-enoyl]amino]phenoxy]butanoate Traditional Name: 4-[2-[[(E)-3-(1-methylindol-5-yl)but-2-enoyl]amino]phenoxy]butyric acid ethyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=CC=C1NC(=O)C=C(C)C2=CC3=C(C=C2)N(C=C3)C

Isomeric SMILES

CCOC(=O)CCCOC1=CC=CC=C1NC(=O)/C=C(\C)/C2=CC3=C(C=C2)N(C=C3)C

InChI

InChI=1S/C25H28N2O4/c1-4-30-25(29)10-7-15-31-23-9-6-5-8-21(23)26-24(28)16-18(2)19-11-12-22-20(17-19)13-14-27(22)3/h5-6,8-9,11-14,16-17H,4,7,10,15H2,1-3H3,(H,26,28)/b18-16+