2-azanyl-1-tert-butyl-4-(4-phenoxyphenyl)pyrrole-3-carbonitrile

Systemtic Name: 2-azanyl-1-tert-butyl-4-(4-phenoxyphenyl)pyrrole-3-carbonitrile Openeye Name: 2-amino-1-tert-butyl-4-(4-phenoxyphenyl)pyrrole-3-carbonitrile CAS Name: 2-amino-1-tert-butyl-4-(4-phenoxyphenyl)-3-pyrrolecarbonitrile IUPAC Name: 2-amino-1-tert-butyl-4-(4-phenoxyphenyl)pyrrole-3-carbonitrile Traditional Name: 2-amino-1-tert-butyl-4-(4-phenoxyphenyl)pyrrole-3-carbonitrile Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=C1N)C#N)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C=C(C(=C1N)C#N)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O/c1-21(2,3)24-14-19(18(13-22)20(24)23)15-9-11-17(12-10-15)25-16-7-5-4-6-8-16/h4-12,14H,23H2,1-3H3