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

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-cyclopropylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-[cyclopropyl(oxo)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl-[(3-methoxyphenyl)methyl]amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(m-anisyl)amino]-1-(cyclopropanecarbonyl)pipecolinamide Formula: C27H42N4O3 MolecularWeight: 470.64738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2CCCCC2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4CC4

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2CCCCC2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4CC4

InChI

InChI=1S/C27H42N4O3/c1-34-24-9-5-8-21(16-24)19-30(18-20-6-3-2-4-7-20)23-12-15-31(27(33)22-10-11-22)25(17-23)26(32)29-14-13-28/h5,8-9,16,20,22-23,25H,2-4,6-7,10-15,17-19,28H2,1H3,(H,29,32)/t23?,25-/m1/s1