4-[1-(1-adamantyl)ethylamino]-3-nitro-benzamide

Systemtic Name: 4-[1-(1-adamantyl)ethylamino]-3-nitro-benzamide Openeye Name: 4-[1-(1-adamantyl)ethylamino]-3-nitro-benzamide CAS Name: 4-[1-(1-adamantyl)ethylamino]-3-nitrobenzamide IUPAC Name: 4-[1-(1-adamantyl)ethylamino]-3-nitrobenzamide Traditional Name: 4-[1-(1-adamantyl)ethylamino]-3-nitro-benzamide Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O3/c1-11(19-8-12-4-13(9-19)6-14(5-12)10-19)21-16-3-2-15(18(20)23)7-17(16)22(24)25/h2-3,7,11-14,21H,4-6,8-10H2,1H3,(H2,20,23)