N-(2-azanylethyl)-1-ethanoyl-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-ethanoyl-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methyl-1-oxopropyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropanoyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[isobutyryl(m-anisyl)amino]pyrrolidine-2-carboxamide Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CC1=CC(=CC=C1)OC)C2CC(N(C2)C(=O)C)C(=O)NCCN

Isomeric SMILES

CC(C)C(=O)N(CC1=CC(=CC=C1)OC)C2CC(N(C2)C(=O)C)C(=O)NCCN

InChI

InChI=1S/C21H32N4O4/c1-14(2)21(28)25(12-16-6-5-7-18(10-16)29-4)17-11-19(20(27)23-9-8-22)24(13-17)15(3)26/h5-7,10,14,17,19H,8-9,11-13,22H2,1-4H3,(H,23,27)