N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-(1-adamantyl)phenyl]-3-methyl-4-nitro-benzamide Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N2O3/c1-15-8-19(2-7-22(15)26(28)29)23(27)25-21-5-3-20(4-6-21)24-12-16-9-17(13-24)11-18(10-16)14-24/h2-8,16-18H,9-14H2,1H3,(H,25,27)