ethyl 4-[[[2-[furan-2-ylmethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-propyl-carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[[2-[furan-2-ylmethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-propyl-carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[[2-[benzyl(2-furylmethyl)amino]-2-oxo-ethyl]-propyl-carbamoyl]amino]benzoate CAS Name: 4-[[[[2-[2-furanylmethyl-(phenylmethyl)amino]-2-oxoethyl]-propylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-propylcarbamoyl]amino]benzoate Traditional Name: 4-[[[2-[benzyl(2-furfuryl)amino]-2-keto-ethyl]-propyl-carbamoyl]amino]benzoic acid ethyl ester Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C27H31N3O5/c1-3-16-29(27(33)28-23-14-12-22(13-15-23)26(32)34-4-2)20-25(31)30(19-24-11-8-17-35-24)18-21-9-6-5-7-10-21/h5-15,17H,3-4,16,18-20H2,1-2H3,(H,28,33)