N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(2-methylpropyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(2-methylpropyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(isobutyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(2-methylpropyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(2-methylpropyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[cyclohexylmethyl(isobutyl)amino]pyrrolidine-2-carboxamide Formula: C26H48N4O2 MolecularWeight: 448.68492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CCCCC1)C2CC(N(C2)C(=O)C)C(=O)NCC3CCCC(C3)CN

Isomeric SMILES

CC(C)CN(CC1CCCCC1)C2CC(N(C2)C(=O)C)C(=O)NCC3CCCC(C3)CN

InChI

InChI=1S/C26H48N4O2/c1-19(2)16-29(17-21-8-5-4-6-9-21)24-13-25(30(18-24)20(3)31)26(32)28-15-23-11-7-10-22(12-23)14-27/h19,21-25H,4-18,27H2,1-3H3,(H,28,32)