ethyl 4-[5-[[(4-tert-butylphenyl)methyl-propan-2-yl-amino]methyl]furan-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-[[(4-tert-butylphenyl)methyl-propan-2-yl-amino]methyl]furan-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-[[(4-tert-butylphenyl)methyl-isopropyl-amino]methyl]furan-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-[[(4-tert-butylphenyl)methyl-propan-2-ylamino]methyl]-2-furanyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[[(4-tert-butylphenyl)methyl-propan-2-ylamino]methyl]furan-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-[[(4-tert-butylbenzyl)-isopropyl-amino]methyl]-2-furoyl]piperazine-1-carboxylic acid ethyl ester Formula: C27H39N3O4 MolecularWeight: 469.61626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN(CC3=CC=C(C=C3)C(C)(C)C)C(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN(CC3=CC=C(C=C3)C(C)(C)C)C(C)C

InChI

InChI=1S/C27H39N3O4/c1-7-33-26(32)29-16-14-28(15-17-29)25(31)24-13-12-23(34-24)19-30(20(2)3)18-21-8-10-22(11-9-21)27(4,5)6/h8-13,20H,7,14-19H2,1-6H3