N-[3-[[2-[(4-chlorophenyl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[2-[(4-chlorophenyl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[2-[(4-chlorobenzoyl)amino]anilino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[2-[[(4-chlorophenyl)-oxomethyl]amino]anilino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-[(4-chlorobenzoyl)amino]anilino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[2-[(4-chlorobenzoyl)amino]anilino]-3-keto-propyl]adamantane-1-carboxamide Formula: C27H30ClN3O3 MolecularWeight: 479.9984

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NC4=CC=CC=C4NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NC4=CC=CC=C4NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H30ClN3O3/c28-21-7-5-20(6-8-21)25(33)31-23-4-2-1-3-22(23)30-24(32)9-10-29-26(34)27-14-17-11-18(15-27)13-19(12-17)16-27/h1-8,17-19H,9-16H2,(H,29,34)(H,30,32)(H,31,33)