N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide iodide

Systemtic Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide iodide Openeye Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-phenyl-tetralin-2-carboxamide iodide CAS Name: N-[4-[(1-methyl-1-piperidin-1-iumyl)methyl]phenyl]-7-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide iodide IUPAC Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide iodide Traditional Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-7-phenyl-tetralin-2-carboxamide iodide Formula: C30H35IN2O MolecularWeight: 566.51617

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC2=CC=C(C=C2)NC(=O)C3CCC4=C(C3)C=C(C=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)CC2=CC=C(C=C2)NC(=O)C3CCC4=C(C3)C=C(C=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C30H34N2O.HI/c1-32(18-6-3-7-19-32)22-23-10-16-29(17-11-23)31-30(33)27-15-13-25-12-14-26(20-28(25)21-27)24-8-4-2-5-9-24;/h2,4-5,8-12,14,16-17,20,27H,3,6-7,13,15,18-19,21-22H2,1H3;1H