oxan-2-ylmethyl 2-[5-methoxy-2-methyl-1-[(E)-3-phenylprop-2-enoyl]indol-3-yl]ethanoate

Systemtic Name: oxan-2-ylmethyl 2-[5-methoxy-2-methyl-1-[(E)-3-phenylprop-2-enoyl]indol-3-yl]ethanoate Openeye Name: tetrahydropyran-2-ylmethyl 2-[5-methoxy-2-methyl-1-[(E)-3-phenylprop-2-enoyl]indol-3-yl]acetate CAS Name: 2-[5-methoxy-2-methyl-1-[(E)-1-oxo-3-phenylprop-2-enyl]-3-indolyl]acetic acid 2-oxanylmethyl ester IUPAC Name: oxan-2-ylmethyl 2-[5-methoxy-2-methyl-1-[(E)-3-phenylprop-2-enoyl]indol-3-yl]acetate Traditional Name: 2-[5-methoxy-2-methyl-1-[(E)-3-phenylacryloyl]indol-3-yl]acetic acid tetrahydropyran-2-ylmethyl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C=CC3=CC=CC=C3)C=CC(=C2)OC)CC(=O)OCC4CCCCO4

Isomeric SMILES

CC1=C(C2=C(N1C(=O)/C=C/C3=CC=CC=C3)C=CC(=C2)OC)CC(=O)OCC4CCCCO4

InChI

InChI=1S/C27H29NO5/c1-19-23(17-27(30)33-18-22-10-6-7-15-32-22)24-16-21(31-2)12-13-25(24)28(19)26(29)14-11-20-8-4-3-5-9-20/h3-5,8-9,11-14,16,22H,6-7,10,15,17-18H2,1-2H3/b14-11+