ethyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-5-[(4-phenoxyphenyl)carbamoylamino]benzoate

Systemtic Name: ethyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-5-[(4-phenoxyphenyl)carbamoylamino]benzoate Openeye Name: ethyl 2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]-5-[(4-phenoxyphenyl)carbamoylamino]benzoate CAS Name: 2-[[(E)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]-5-[[oxo-(4-phenoxyanilino)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-5-[(4-phenoxyphenyl)carbamoylamino]benzoate Traditional Name: 2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]-5-[(4-phenoxyphenyl)carbamoylamino]benzoic acid ethyl ester Formula: C36H31N3O5 MolecularWeight: 585.64844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C=C(C)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)/C=C(\C)/C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C36H31N3O5/c1-3-43-35(41)32-23-29(38-36(42)37-28-15-18-31(19-16-28)44-30-11-5-4-6-12-30)17-20-33(32)39-34(40)21-24(2)26-14-13-25-9-7-8-10-27(25)22-26/h4-23H,3H2,1-2H3,(H,39,40)(H2,37,38,42)/b24-21+