(2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-ethanoyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-ethanoyl-piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl(m-anisyl)amino]pipecolinamide Formula: C25H40N4O3 MolecularWeight: 444.6101

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NCCN)N(CC2CCCCC2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NCCN)N(CC2CCCCC2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H40N4O3/c1-19(30)29-14-11-22(16-24(29)25(31)27-13-12-26)28(17-20-7-4-3-5-8-20)18-21-9-6-10-23(15-21)32-2/h6,9-10,15,20,22,24H,3-5,7-8,11-14,16-18,26H2,1-2H3,(H,27,31)/t22?,24-/m1/s1