ethyl 4-(3-cyano-4-phenylmethoxy-indol-1-yl)benzoate

Systemtic Name: ethyl 4-(3-cyano-4-phenylmethoxy-indol-1-yl)benzoate Openeye Name: ethyl 4-(4-benzyloxy-3-cyano-indol-1-yl)benzoate CAS Name: 4-(3-cyano-4-phenylmethoxy-1-indolyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-cyano-4-phenylmethoxyindol-1-yl)benzoate Traditional Name: 4-(4-benzoxy-3-cyano-indol-1-yl)benzoic acid ethyl ester Formula: C25H20N2O3 MolecularWeight: 396.4379

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=C(C3=C2C=CC=C3OCC4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=C(C3=C2C=CC=C3OCC4=CC=CC=C4)C#N

InChI

InChI=1S/C25H20N2O3/c1-2-29-25(28)19-11-13-21(14-12-19)27-16-20(15-26)24-22(27)9-6-10-23(24)30-17-18-7-4-3-5-8-18/h3-14,16H,2,17H2,1H3