(2R)-N-(1-adamantylcarbamoyl)-2-(4-chloranyl-2-nitro-phenoxy)propanamide

Systemtic Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-chloranyl-2-nitro-phenoxy)propanamide Openeye Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-chloro-2-nitro-phenoxy)propanamide CAS Name: (2R)-N-[(1-adamantylamino)-oxomethyl]-2-(4-chloro-2-nitrophenoxy)propanamide IUPAC Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-chloro-2-nitrophenoxy)propanamide Traditional Name: (2R)-N-(1-adamantylcarbamoyl)-2-(4-chloro-2-nitro-phenoxy)propionamide Formula: C20H24ClN3O5 MolecularWeight: 421.87466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H24ClN3O5/c1-11(29-17-3-2-15(21)7-16(17)24(27)28)18(25)22-19(26)23-20-8-12-4-13(9-20)6-14(5-12)10-20/h2-3,7,11-14H,4-6,8-10H2,1H3,(H2,22,23,25,26)/t11-,12?,13?,14?,20?/m1/s1