N-[4-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-[4-[(4-methoxyphenyl)carbamoyl]anilino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-[4-[(4-methoxyanilino)-oxomethyl]anilino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[4-[(4-methoxyphenyl)carbamoyl]anilino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-keto-4-[4-[(4-methoxyphenyl)carbamoyl]anilino]butyl]adamantane-1-carboxamide Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H35N3O4/c1-36-25-10-8-24(9-11-25)32-27(34)22-4-6-23(7-5-22)31-26(33)3-2-12-30-28(35)29-16-19-13-20(17-29)15-21(14-19)18-29/h4-11,19-21H,2-3,12-18H2,1H3,(H,30,35)(H,31,33)(H,32,34)