ethyl 4-[[(E)-3-anthracen-9-yl-2-benzamido-prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-3-anthracen-9-yl-2-benzamido-prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(9-anthryl)-2-benzamido-prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(9-anthracenyl)-2-benzamido-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-anthracen-9-yl-2-benzamidoprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(9-anthryl)-2-benzamido-acryloyl]amino]benzoic acid ethyl ester Formula: C33H26N2O4 MolecularWeight: 514.57054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C\C2=C3C=CC=CC3=CC4=CC=CC=C42)/NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H26N2O4/c1-2-39-33(38)23-16-18-26(19-17-23)34-32(37)30(35-31(36)22-10-4-3-5-11-22)21-29-27-14-8-6-12-24(27)20-25-13-7-9-15-28(25)29/h3-21H,2H2,1H3,(H,34,37)(H,35,36)/b30-21+