azane; (E)-4-oxidanylidene-4-[6-oxidanylidene-6-(4-pyrrolidin-1-ylphenyl)hexoxy]but-2-enoate

Systemtic Name: azane; (E)-4-oxidanylidene-4-[6-oxidanylidene-6-(4-pyrrolidin-1-ylphenyl)hexoxy]but-2-enoate Openeye Name: ammonia; (E)-4-oxo-4-[6-oxo-6-(4-pyrrolidin-1-ylphenyl)hexoxy]but-2-enoate CAS Name: ammonia; (E)-4-oxo-4-[6-oxo-6-[4-(1-pyrrolidinyl)phenyl]hexoxy]-2-butenoate IUPAC Name: azane; (E)-4-oxo-4-[6-oxo-6-(4-pyrrolidin-1-ylphenyl)hexoxy]but-2-enoate Traditional Name: ammonia; (E)-4-keto-4-[6-keto-6-(4-pyrrolidinophenyl)hexoxy]but-2-enoate Formula: C20H27N2O5- MolecularWeight: 375.43878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=O)CCCCCOC(=O)C=CC(=O)[O-].N

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=O)CCCCCOC(=O)/C=C/C(=O)[O-].N

InChI

InChI=1S/C20H25NO5.H3N/c22-18(6-2-1-5-15-26-20(25)12-11-19(23)24)16-7-9-17(10-8-16)21-13-3-4-14-21;/h7-12H,1-6,13-15H2,(H,23,24);1H3/p-1/b12-11+;