1-adamantyl-[2-[(3,4-diethoxyphenyl)carbamoylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[(3,4-diethoxyphenyl)carbamoylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[(3,4-diethoxyphenyl)carbamoylamino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[[(3,4-diethoxyanilino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[(3,4-diethoxyphenyl)carbamoylamino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[(3,4-diethoxyphenyl)carbamoylamino]-2-keto-ethyl]ammonium Formula: C23H34N3O4+ MolecularWeight: 416.53376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)OCC

InChI

InChI=1S/C23H33N3O4/c1-3-29-19-6-5-18(10-20(19)30-4-2)25-22(28)26-21(27)14-24-23-11-15-7-16(12-23)9-17(8-15)13-23/h5-6,10,15-17,24H,3-4,7-9,11-14H2,1-2H3,(H2,25,26,27,28)/p+1