N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C=C(C(=N4)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C(C)N4C=C(C(=N4)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O4/c1-4-17(20-8-13-5-14(9-20)7-15(6-13)10-20)21-18(25)12(2)23-11-16(24(26)27)19(22-23)28-3/h11-15,17H,4-10H2,1-3H3,(H,21,25)