N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-4-nitro-benzamide Openeye Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-4-nitro-benzamide CAS Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-4-nitrobenzamide IUPAC Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-4-nitrobenzamide Traditional Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-4-nitro-benzamide Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H25N3O3/c1-13(9-20-10-14-6-15(11-20)8-16(7-14)12-20)21-22-19(24)17-2-4-18(5-3-17)23(25)26/h2-5,14-16H,6-12H2,1H3,(H,22,24)/b21-13-