N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-piperonylamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC2=C(C=C1)OCO2)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=N/NC(=O)C1=CC2=C(C=C1)OCO2)/CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N2O3/c1-13(8-21-9-14-4-15(10-21)6-16(5-14)11-21)22-23-20(24)17-2-3-18-19(7-17)26-12-25-18/h2-3,7,14-16H,4-6,8-12H2,1H3,(H,23,24)/b22-13-