prop-2-enyl 3-[3-(3,3-dimethylbutanoyl)-1-prop-2-enyl-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethyl-propanoate

Systemtic Name: prop-2-enyl 3-[3-(3,3-dimethylbutanoyl)-1-prop-2-enyl-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethyl-propanoate Openeye Name: allyl 3-[1-allyl-3-(3,3-dimethylbutanoyl)-5-(2-quinolylmethoxy)indol-2-yl]-2,2-dimethyl-propanoate CAS Name: 3-[3-(3,3-dimethyl-1-oxobutyl)-1-prop-2-enyl-5-(2-quinolinylmethoxy)-2-indolyl]-2,2-dimethylpropanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-[3-(3,3-dimethylbutanoyl)-1-prop-2-enyl-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoate Traditional Name: 3-[1-allyl-3-(3,3-dimethylbutanoyl)-5-(2-quinolylmethoxy)indol-2-yl]-2,2-dimethyl-propionic acid allyl ester Formula: C35H40N2O4 MolecularWeight: 552.7031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)C1=C(N(C2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC=C)CC(C)(C)C(=O)OCC=C

Isomeric SMILES

CC(C)(C)CC(=O)C1=C(N(C2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC=C)CC(C)(C)C(=O)OCC=C

InChI

InChI=1S/C35H40N2O4/c1-8-18-37-29-17-16-26(41-23-25-15-14-24-12-10-11-13-28(24)36-25)20-27(29)32(31(38)22-34(3,4)5)30(37)21-35(6,7)33(39)40-19-9-2/h8-17,20H,1-2,18-19,21-23H2,3-7H3