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

Systemtic Name: (2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(3-methoxyphenyl)methyl-(2-methylpropyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[isobutyl-[(3-methoxyphenyl)methyl]amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(3-methoxyphenyl)methyl-(2-methylpropyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[isobutyl(m-anisyl)amino]pipecolinamide Formula: C22H36N4O3 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=CC=C1)OC)C2CCN(C(C2)C(=O)NCCN)C(=O)C

Isomeric SMILES

CC(C)CN(CC1=CC(=CC=C1)OC)C2CCN([C@H](C2)C(=O)NCCN)C(=O)C

InChI

InChI=1S/C22H36N4O3/c1-16(2)14-25(15-18-6-5-7-20(12-18)29-4)19-8-11-26(17(3)27)21(13-19)22(28)24-10-9-23/h5-7,12,16,19,21H,8-11,13-15,23H2,1-4H3,(H,24,28)/t19?,21-/m1/s1