2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[1-adamantylmethyl(methyl)amino]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN(C)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN(C)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29N3O3/c1-14-18(4-3-5-19(14)24(26)27)22-20(25)12-23(2)13-21-9-15-6-16(10-21)8-17(7-15)11-21/h3-5,15-17H,6-13H2,1-2H3,(H,22,25)