N-[4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-chloro-2-methoxy-5-methyl-anilino)-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-(4-chloro-2-methoxy-5-methylanilino)-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-chloro-2-methoxy-5-methylanilino)-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-chloro-2-methoxy-5-methyl-anilino)-4-keto-butyl]adamantane-1-carboxamide Formula: C23H31ClN2O3 MolecularWeight: 418.95684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H31ClN2O3/c1-14-6-19(20(29-2)10-18(14)24)26-21(27)4-3-5-25-22(28)23-11-15-7-16(12-23)9-17(8-15)13-23/h6,10,15-17H,3-5,7-9,11-13H2,1-2H3,(H,25,28)(H,26,27)