N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-[2-(3,4-diethoxyphenyl)ethylamino]-4-keto-butyl]adamantane-1-carboxamide Formula: C27H40N2O4 MolecularWeight: 456.6175

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3)OCC

InChI

InChI=1S/C27H40N2O4/c1-3-32-23-8-7-19(15-24(23)33-4-2)9-11-28-25(30)6-5-10-29-26(31)27-16-20-12-21(17-27)14-22(13-20)18-27/h7-8,15,20-22H,3-6,9-14,16-18H2,1-2H3,(H,28,30)(H,29,31)