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

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(4-methylphenyl)methyl]amino]-1-ethanoyl-piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclopropyl(p-tolylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclopropyl-[(4-methylphenyl)methyl]amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclopropyl-[(4-methylphenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[cyclopropyl-(4-methylbenzyl)amino]pipecolinamide Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CC2)C3CCN(C(C3)C(=O)NCCN)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CC2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C

InChI

InChI=1S/C21H32N4O2/c1-15-3-5-17(6-4-15)14-25(18-7-8-18)19-9-12-24(16(2)26)20(13-19)21(27)23-11-10-22/h3-6,18-20H,7-14,22H2,1-2H3,(H,23,27)/t19?,20-/m1/s1