2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]acetamide CAS Name: 2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)methylideneamino]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)methylideneamino]acetamide Traditional Name: 2-(1-adamantyl)-N-[(E)-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]acetamide Formula: C22H31N3O MolecularWeight: 353.50104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=NNC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=N/NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H31N3O/c1-14-5-19(15(2)25(14)20-3-4-20)13-23-24-21(26)12-22-9-16-6-17(10-22)8-18(7-16)11-22/h5,13,16-18,20H,3-4,6-12H2,1-2H3,(H,24,26)/b23-13+