1-adamantyl-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(4-butylanilino)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(4-butylanilino)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(4-butylanilino)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-(4-butylanilino)-2-keto-ethyl]ammonium Formula: C22H33N2O+ MolecularWeight: 341.51022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N2O/c1-2-3-4-16-5-7-20(8-6-16)24-21(25)15-23-22-12-17-9-18(13-22)11-19(10-17)14-22/h5-8,17-19,23H,2-4,9-15H2,1H3,(H,24,25)/p+1