N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OCC

InChI

InChI=1S/C24H26N2O5/c1-5-12-26-23(28)18-10-8-17(13-19(18)24(26)29)22(27)25-15(4)16-9-11-20(30-6-2)21(14-16)31-7-3/h5,8-11,13-15H,1,6-7,12H2,2-4H3,(H,25,27)/t15-/m0/s1