methyl 2-[2-[(5-chloranyl-2-pyrrolidin-1-yl-phenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(5-chloranyl-2-pyrrolidin-1-yl-phenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(5-chloro-2-pyrrolidin-1-yl-anilino)acetyl]amino]benzoate CAS Name: 2-[[2-[5-chloro-2-(1-pyrrolidinyl)anilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(5-chloro-2-pyrrolidin-1-ylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(5-chloro-2-pyrrolidino-anilino)acetyl]amino]benzoic acid methyl ester Formula: C20H22ClN3O3 MolecularWeight: 387.85998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CNC2=C(C=CC(=C2)Cl)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CNC2=C(C=CC(=C2)Cl)N3CCCC3

InChI

InChI=1S/C20H22ClN3O3/c1-27-20(26)15-6-2-3-7-16(15)23-19(25)13-22-17-12-14(21)8-9-18(17)24-10-4-5-11-24/h2-3,6-9,12,22H,4-5,10-11,13H2,1H3,(H,23,25)