phenanthridin-6-ylmethyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: phenanthridin-6-ylmethyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: phenanthridin-6-ylmethyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid phenanthridin-6-ylmethyl ester Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C26H22N2O3/c29-25-10-5-15-28(25)16-18-11-13-19(14-12-18)26(30)31-17-24-22-8-2-1-6-20(22)21-7-3-4-9-23(21)27-24/h1-4,6-9,11-14H,5,10,15-17H2