ethyl 3-[3-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-2-oxidanylidene-1-pentyl-indol-3-yl]propanoate

Systemtic Name: ethyl 3-[3-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-2-oxidanylidene-1-pentyl-indol-3-yl]propanoate Openeye Name: ethyl 3-[3-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-2-oxo-1-pentyl-indolin-3-yl]propanoate CAS Name: 3-[3-[[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-2-oxo-1-pentyl-3-indolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-2-oxo-1-pentylindol-3-yl]propanoate Traditional Name: 3-[1-amyl-2-keto-3-[[(E)-3-(3-methoxyphenyl)acryloyl]amino]indolin-3-yl]propionic acid ethyl ester Formula: C28H34N2O5 MolecularWeight: 478.57996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(C1=O)(CCC(=O)OCC)NC(=O)C=CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(C1=O)(CCC(=O)OCC)NC(=O)/C=C/C3=CC(=CC=C3)OC

InChI

InChI=1S/C28H34N2O5/c1-4-6-9-19-30-24-14-8-7-13-23(24)28(27(30)33,18-17-26(32)35-5-2)29-25(31)16-15-21-11-10-12-22(20-21)34-3/h7-8,10-16,20H,4-6,9,17-19H2,1-3H3,(H,29,31)/b16-15+