N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Formula: C33H42N4O3 MolecularWeight: 542.71158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5)C(=O)N7CCCC7

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5)C(=O)N7CCCC7

InChI

InChI=1S/C33H42N4O3/c1-40-30-7-3-2-6-29(30)36-14-12-35(13-15-36)28-9-8-26(19-27(28)31(38)37-10-4-5-11-37)34-32(39)33-20-23-16-24(21-33)18-25(17-23)22-33/h2-3,6-9,19,23-25H,4-5,10-18,20-22H2,1H3,(H,34,39)