ethyl 6-[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoate

Systemtic Name: ethyl 6-[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoate Openeye Name: ethyl 6-[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoate CAS Name: 6-[[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)anilino]-oxomethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoate Traditional Name: 6-[[2-methyl-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid ethyl ester Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCNC(=O)NC1=C(C=CC(=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)CCCCCNC(=O)NC1=C(C=CC(=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C29H31N3O4/c1-3-35-27(33)12-8-5-9-17-30-29(34)32-24-19-23(14-13-20(24)2)28-31-25-18-22(15-16-26(25)36-28)21-10-6-4-7-11-21/h4,6-7,10-11,13-16,18-19H,3,5,8-9,12,17H2,1-2H3,(H2,30,32,34)