(2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-1-ethanoyl-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[2-methoxyethyl(o-tolylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-(2-methylbenzyl)amino]pipecolinamide Formula: C25H40N4O3 MolecularWeight: 444.6101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCOC)C2CCN(C(C2)C(=O)NC3CCC(CC3)N)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1CN(CCOC)C2CCN([C@H](C2)C(=O)NC3CCC(CC3)N)C(=O)C

InChI

InChI=1S/C25H40N4O3/c1-18-6-4-5-7-20(18)17-28(14-15-32-3)23-12-13-29(19(2)30)24(16-23)25(31)27-22-10-8-21(26)9-11-22/h4-7,21-24H,8-17,26H2,1-3H3,(H,27,31)/t21?,22?,23?,24-/m1/s1