ethyl 4-[[3-[(4-fluorophenyl)methylcarbamoyl]-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[3-[(4-fluorophenyl)methylcarbamoyl]-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[3-[(4-fluorophenyl)methylcarbamoyl]-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate CAS Name: 4-[[[3-[[(4-fluorophenyl)methylamino]-oxomethyl]-4-(1-pyrrolidinyl)anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(4-fluorophenyl)methylcarbamoyl]-4-pyrrolidin-1-ylphenyl]carbamoylamino]benzoate Traditional Name: 4-[[3-[(4-fluorobenzyl)carbamoyl]-4-pyrrolidino-phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C28H29FN4O4 MolecularWeight: 504.552663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C28H29FN4O4/c1-2-37-27(35)20-7-11-22(12-8-20)31-28(36)32-23-13-14-25(33-15-3-4-16-33)24(17-23)26(34)30-18-19-5-9-21(29)10-6-19/h5-14,17H,2-4,15-16,18H2,1H3,(H,30,34)(H2,31,32,36)