N-[[(2R)-1-(2-adamantyl)pyrrolidin-2-yl]methyl]-4-bromanyl-1-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[[(2R)-1-(2-adamantyl)pyrrolidin-2-yl]methyl]-4-bromanyl-1-methoxy-naphthalene-2-carboxamide Openeye Name: N-[[(2R)-1-(2-adamantyl)pyrrolidin-2-yl]methyl]-4-bromo-1-methoxy-naphthalene-2-carboxamide CAS Name: N-[[(2R)-1-(2-adamantyl)-2-pyrrolidinyl]methyl]-4-bromo-1-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[[(2R)-1-(2-adamantyl)pyrrolidin-2-yl]methyl]-4-bromo-1-methoxynaphthalene-2-carboxamide Traditional Name: N-[[(2R)-1-(2-adamantyl)pyrrolidin-2-yl]methyl]-4-bromo-1-methoxy-2-naphthamide Formula: C27H33BrN2O2 MolecularWeight: 497.46712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=CC=CC=C21)Br)C(=O)NCC3CCCN3C4C5CC6CC(C5)CC4C6

Isomeric SMILES

COC1=C(C=C(C2=CC=CC=C21)Br)C(=O)NC[C@H]3CCCN3C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C27H33BrN2O2/c1-32-26-22-7-3-2-6-21(22)24(28)14-23(26)27(31)29-15-20-5-4-8-30(20)25-18-10-16-9-17(12-18)13-19(25)11-16/h2-3,6-7,14,16-20,25H,4-5,8-13,15H2,1H3,(H,29,31)/t16?,17?,18?,19?,20-,25?/m1/s1