N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC(C)C23CC4CC(C2)CC(C4)C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N[C@H](C)C23CC4CC(C2)CC(C4)C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O3/c1-12-19(24(26)27)13(2)23(22-12)5-4-18(25)21-14(3)20-9-15-6-16(10-20)8-17(7-15)11-20/h14-17H,4-11H2,1-3H3,(H,21,25)/t14-,15?,16?,17?,20?/m1/s1