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

Systemtic Name: 1-adamantyl-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(4-ethoxycarbonylanilino)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-(4-carbethoxyanilino)-2-keto-ethyl]ammonium Formula: C21H29N2O3+ MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3/c1-2-26-20(25)17-3-5-18(6-4-17)23-19(24)13-22-21-10-14-7-15(11-21)9-16(8-14)12-21/h3-6,14-16,22H,2,7-13H2,1H3,(H,23,24)/p+1