phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-(3-fluorophenyl)carbonyl-imidazolidine-1-carboxylate

Systemtic Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-(3-fluorophenyl)carbonyl-imidazolidine-1-carboxylate Openeye Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-(3-fluorobenzoyl)imidazolidine-1-carboxylate CAS Name: 2-[[[3-(aminomethyl)phenyl]methylamino]-oxomethyl]-3-[(3-fluorophenyl)-oxomethyl]-1-imidazolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-(3-fluorobenzoyl)imidazolidine-1-carboxylate Traditional Name: 2-[[3-(aminomethyl)benzyl]carbamoyl]-3-(3-fluorobenzoyl)imidazolidine-1-carboxylic acid phenyl ester Formula: C26H25FN4O4 MolecularWeight: 476.499503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)C2=CC(=CC=C2)F)C(=O)NCC3=CC=CC(=C3)CN)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CN(C(N1C(=O)C2=CC(=CC=C2)F)C(=O)NCC3=CC=CC(=C3)CN)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C26H25FN4O4/c27-21-9-5-8-20(15-21)25(33)30-12-13-31(26(34)35-22-10-2-1-3-11-22)24(30)23(32)29-17-19-7-4-6-18(14-19)16-28/h1-11,14-15,24H,12-13,16-17,28H2,(H,29,32)