N-[3-azanyl-1-(3-ethoxy-4-methoxy-phenyl)-3-oxidanylidene-propyl]-1,3-bis(oxidanylidene)isoindole-2-carboxamide

Systemtic Name: N-[3-azanyl-1-(3-ethoxy-4-methoxy-phenyl)-3-oxidanylidene-propyl]-1,3-bis(oxidanylidene)isoindole-2-carboxamide Openeye Name: N-[3-amino-1-(3-ethoxy-4-methoxy-phenyl)-3-oxo-propyl]-1,3-dioxo-isoindoline-2-carboxamide CAS Name: N-[3-amino-1-(3-ethoxy-4-methoxyphenyl)-3-oxopropyl]-1,3-dioxo-2-isoindolecarboxamide IUPAC Name: N-[3-amino-1-(3-ethoxy-4-methoxyphenyl)-3-oxopropyl]-1,3-dioxoisoindole-2-carboxamide Traditional Name: N-[3-amino-1-(3-ethoxy-4-methoxy-phenyl)-3-keto-propyl]-1,3-diketo-isoindoline-2-carboxamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC(=O)N)NC(=O)N2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC(=O)N)NC(=O)N2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H21N3O6/c1-3-30-17-10-12(8-9-16(17)29-2)15(11-18(22)25)23-21(28)24-19(26)13-6-4-5-7-14(13)20(24)27/h4-10,15H,3,11H2,1-2H3,(H2,22,25)(H,23,28)