N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide

Systemtic Name: N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Openeye Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide CAS Name: N-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-3-(4-methoxyphenyl)-1-adamantanecarboxamide IUPAC Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Traditional Name: N-[4-(cyclopropanecarbonylamino)benzyl]-3-(4-methoxyphenyl)adamantane-1-carboxamide Formula: C29H34N2O3 MolecularWeight: 458.59186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NCC5=CC=C(C=C5)NC(=O)C6CC6

Isomeric SMILES

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NCC5=CC=C(C=C5)NC(=O)C6CC6

InChI

InChI=1S/C29H34N2O3/c1-34-25-10-6-23(7-11-25)28-13-20-12-21(14-28)16-29(15-20,18-28)27(33)30-17-19-2-8-24(9-3-19)31-26(32)22-4-5-22/h2-3,6-11,20-22H,4-5,12-18H2,1H3,(H,30,33)(H,31,32)