N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[2-morpholin-4-ylethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-4-[2-morpholin-4-ylethyl-(phenylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[benzyl(2-morpholinoethyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3-methoxyphenyl)-oxomethyl]-4-[2-(4-morpholinyl)ethyl-(phenylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-4-[benzyl(2-morpholin-4-ylethyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[benzyl(2-morpholinoethyl)amino]-1-m-anisoyl-pyrrolidine-2-carboxamide Formula: C28H39N5O4 MolecularWeight: 509.64036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CCN3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CCN3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H39N5O4/c1-36-25-9-5-8-23(18-25)28(35)33-21-24(19-26(33)27(34)30-11-10-29)32(20-22-6-3-2-4-7-22)13-12-31-14-16-37-17-15-31/h2-9,18,24,26H,10-17,19-21,29H2,1H3,(H,30,34)