ethyl 4-[(3-cyanocyclohepta[b]pyrrol-2-yl)amino]benzoate

Systemtic Name: ethyl 4-[(3-cyanocyclohepta[b]pyrrol-2-yl)amino]benzoate Openeye Name: ethyl 4-[(3-cyanocyclohepta[b]pyrrol-2-yl)amino]benzoate CAS Name: 4-[(3-cyano-2-cyclohepta[b]pyrrolyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-cyanocyclohepta[b]pyrrol-2-yl)amino]benzoate Traditional Name: 4-[(3-cyanocyclohepta[b]pyrrol-2-yl)amino]benzoic acid ethyl ester Formula: C19H15N3O2 MolecularWeight: 317.3413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=C(C3=CC=CC=CC3=N2)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=C(C3=CC=CC=CC3=N2)C#N

InChI

InChI=1S/C19H15N3O2/c1-2-24-19(23)13-8-10-14(11-9-13)21-18-16(12-20)15-6-4-3-5-7-17(15)22-18/h3-11H,2H2,1H3,(H,21,22)