2-dimethylaminoethyl 4-(1-adamantylcarbamoylamino)benzoate

Systemtic Name: 2-dimethylaminoethyl 4-(1-adamantylcarbamoylamino)benzoate Openeye Name: 2-dimethylaminoethyl 4-(1-adamantylcarbamoylamino)benzoate CAS Name: 4-[[(1-adamantylamino)-oxomethyl]amino]benzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 4-(1-adamantylcarbamoylamino)benzoate Traditional Name: 4-(1-adamantylcarbamoylamino)benzoic acid 2-dimethylaminoethyl ester Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H31N3O3/c1-25(2)7-8-28-20(26)18-3-5-19(6-4-18)23-21(27)24-22-12-15-9-16(13-22)11-17(10-15)14-22/h3-6,15-17H,7-14H2,1-2H3,(H2,23,24,27)