methyl 4-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]benzoate Openeye Name: methyl 4-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]benzoate CAS Name: 4-[[[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]carbamoyl]benzoate Traditional Name: 4-[[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]carbamoyl]benzoic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=C(C=C2)C(=O)OC)N3CCCC3

InChI

InChI=1S/C22H26N2O4/c1-27-19-7-5-6-18(14-19)20(24-12-3-4-13-24)15-23-21(25)16-8-10-17(11-9-16)22(26)28-2/h5-11,14,20H,3-4,12-13,15H2,1-2H3,(H,23,25)