[1-[3-[4-[(2-butyl-1-benzofuran-3-yl)carbonyl]phenoxy]propyl-propan-2-yl-amino]-1-oxidanylidene-propan-2-yl] propanoate

Systemtic Name: [1-[3-[4-[(2-butyl-1-benzofuran-3-yl)carbonyl]phenoxy]propyl-propan-2-yl-amino]-1-oxidanylidene-propan-2-yl] propanoate Openeye Name: [2-[3-[4-(2-butylbenzofuran-3-carbonyl)phenoxy]propyl-isopropyl-amino]-1-methyl-2-oxo-ethyl] propanoate CAS Name: propanoic acid [1-[3-[4-[(2-butyl-3-benzofuranyl)-oxomethyl]phenoxy]propyl-propan-2-ylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[3-[4-(2-butyl-1-benzofuran-3-carbonyl)phenoxy]propyl-propan-2-ylamino]-1-oxopropan-2-yl] propanoate Traditional Name: propionic acid [2-[3-[4-(2-butylbenzofuran-3-carbonyl)phenoxy]propyl-isopropyl-amino]-2-keto-1-methyl-ethyl] ester Formula: C31H39NO6 MolecularWeight: 521.64446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OCCCN(C(C)C)C(=O)C(C)OC(=O)CC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OCCCN(C(C)C)C(=O)C(C)OC(=O)CC

InChI

InChI=1S/C31H39NO6/c1-6-8-13-27-29(25-12-9-10-14-26(25)38-27)30(34)23-15-17-24(18-16-23)36-20-11-19-32(21(3)4)31(35)22(5)37-28(33)7-2/h9-10,12,14-18,21-22H,6-8,11,13,19-20H2,1-5H3