ethyl 3-[[4-[[azanyl-(4-tert-butylcyclohexyl)amino]methyl]phenyl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[4-[[azanyl-(4-tert-butylcyclohexyl)amino]methyl]phenyl]carbonylamino]propanoate Openeye Name: ethyl 3-[[4-[[amino-(4-tert-butylcyclohexyl)amino]methyl]benzoyl]amino]propanoate CAS Name: 3-[[[4-[[amino-(4-tert-butylcyclohexyl)amino]methyl]phenyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[[amino-(4-tert-butylcyclohexyl)amino]methyl]benzoyl]amino]propanoate Traditional Name: 3-[[4-[[amino-(4-tert-butylcyclohexyl)amino]methyl]benzoyl]amino]propionic acid ethyl ester Formula: C23H37N3O3 MolecularWeight: 403.55818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C1=CC=C(C=C1)CN(C2CCC(CC2)C(C)(C)C)N

Isomeric SMILES

CCOC(=O)CCNC(=O)C1=CC=C(C=C1)CN(C2CCC(CC2)C(C)(C)C)N

InChI

InChI=1S/C23H37N3O3/c1-5-29-21(27)14-15-25-22(28)18-8-6-17(7-9-18)16-26(24)20-12-10-19(11-13-20)23(2,3)4/h6-9,19-20H,5,10-16,24H2,1-4H3,(H,25,28)