N-[2-(2-chloranyl-6-fluoranyl-phenyl)-2-pyrrolidin-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide

Systemtic Name: N-[2-(2-chloranyl-6-fluoranyl-phenyl)-2-pyrrolidin-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Openeye Name: N-[2-(2-chloro-6-fluoro-phenyl)-2-pyrrolidin-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide CAS Name: N-[2-(2-chloro-6-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]-3-[[(4-methoxyanilino)-oxomethyl]amino]propanamide IUPAC Name: N-[2-(2-chloro-6-fluorophenyl)-2-pyrrolidin-1-ylethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Traditional Name: N-[2-(2-chloro-6-fluoro-phenyl)-2-pyrrolidino-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propionamide Formula: C23H28ClFN4O3 MolecularWeight: 462.944823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NCC(C2=C(C=CC=C2Cl)F)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NCC(C2=C(C=CC=C2Cl)F)N3CCCC3

InChI

InChI=1S/C23H28ClFN4O3/c1-32-17-9-7-16(8-10-17)28-23(31)26-12-11-21(30)27-15-20(29-13-2-3-14-29)22-18(24)5-4-6-19(22)25/h4-10,20H,2-3,11-15H2,1H3,(H,27,30)(H2,26,28,31)